SCHEMBL372637

SCHEMBL372637

NC1CCC(N2CCN(CC3CC3)CC2)CC1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CHRM5 P08912 2/20 0.39
ADRA2C P18825 1/20 0.39
KDM4E B2RXH2 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
ACHE P22303 1/20 0.34
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
KDM1A O60341 1/20 0.31
OPRM1 P35372 1/20 0.31
OPRD1 P41143 1/20 0.31
OPRK1 P41145 1/20 0.31
OPRL1 P41146 1/20 0.31
DRD2 P14416 1/20 0.31
CHRM2 P08172 1/20 0.30
CHRM4 P08173 1/20 0.30
CHRM1 P11229 1/20 0.30
SIGMAR1 Q99720 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL372638 1.00 CHRM5 (0.39) CHRM5ADRA2CKDM4ETDP1ACHE
SCHEMBL842660 1.00 CHRM5 (0.39) CHRM5ADRA2CKDM4ETDP1ACHE
Hydrochloric Acid SCHEMBL3487702 0.98 CHRM5 (0.38) CHRM5ADRA2CKDM4ETDP1ACHE
Hydrochloric Acid SCHEMBL19002911 0.98 CHRM5 (0.38) CHRM5ADRA2CKDM4ETDP1ACHE
Hydrochloric Acid SCHEMBL19002912 0.98 CHRM5 (0.38) CHRM5ADRA2CKDM4ETDP1ACHE
Hydrochloric Acid SCHEMBL3487703 0.98 CHRM5 (0.38) CHRM5ADRA2CKDM4ETDP1ACHE
SCHEMBL1204165 0.93 CHRM5 (0.42) CHRM5ADRA2CKDM4ETDP1ACHE
SCHEMBL24474498 0.92 CHRM5 (0.50) CHRM5ADRA2CKDM4ETDP1ACHE
SCHEMBL30697248 0.92 CHRM5 (0.50) CHRM5ADRA2CKDM4ETDP1ACHE
SCHEMBL22570086 0.91 CHRM5 (0.53) CHRM5ADRA2CKDM4ETDP1ACHE

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 123 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7816530-B2 cis- or trans-4-(4-cyclopropylmethyl-piperazin-1-yl)-cyclohexylamine; antiinflammatory and antiproliferative activity; antiviral and anticarcinogenic agent BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2010-10-19 US claimed
US-20080293944-A1 Piperazinyl Compounds ONCOHEROES BIOSCIENCES INC. 2008-11-27 US claimed
EP-1599478-B1 DIHYDROPTERIDINONES, METHOD FOR THE PRODUCTION AND USE THEREOF IN THE FORM OF DRUGS BOEHRINGER INGELHEIM PHARMA (DE) 2007-05-09 EP claimed
US-20060025411-A1 Methods for treating diseases or conditions using dihydropteridinone compounds BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2006-02-02 US claimed
EP-3560499-B1 DIHYDROPTERIDINONES FOR THE TREATMENT OF CANCER DISEASES ONCOHEROES BIOSCIENCES INC (US) 2024-03-06 EP disclosed
CN-115109032-B Quinoline derivative and application thereof in medicine 成都百裕制药股份有限公司 2023-09-05 CN disclosed
CN-115109032-A Quinoline derivative and application thereof in medicine 成都百裕制药股份有限公司 2022-09-27 CN disclosed
WO-2022194237-A1 QUINOLINE DERIVATIVE AND APPLICATION THEREOF IN PREPARATION OF AUTOIMMUNE DRUG 成都百裕制药股份有限公司 2022-09-22 WO disclosed
EP-3858835-A1 PYRIMIDINE-BASED ANTIPROLIFERATIVE AGENTS G1 Therapeutics, Inc. (US) 2021-08-04 EP disclosed
US-20210047328-A1 PYRIMIDINE-BASED ANTIPROLIFERATIVE AGENTS G1 THERAPEUTICS, INC. (US) 2021-02-18 US disclosed
US-10829490-B2 Substituted dihydropyrazino[1 ′,2′:1,5]pyrrolo[2,3-d]pyrimidine-based antiproliferative agents GI Therapeutics, Inc. (US) 2020-11-10 US disclosed
EP-1778240-B1 DIHYDROPTERIDINONES FOR THE TREATMENT OF CANCER DISEASES ONCOHEROES BIOSCIENCES INC (US) 2020-03-25 EP disclosed
US-20060035903-A1 Storage stable perfusion solution for dihydropteridinones BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2006-02-16 US disclosed
US-20060025411-A1 Methods for treating diseases or conditions using dihydropteridinone compounds BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2006-02-02 US disclosed
EP-1599478-A1 DIHYDROPTERIDINONES, METHOD FOR THE PRODUCTION AND USE THEREOF IN THE FORM OF DRUGS Boehringer Ingelheim Pharma GmbH & Co.KG (DE) 2005-11-30 EP disclosed
US-6861422-B2 Dihydropteridinones, processes for preparing them and their use as pharmaceutical compositions BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2005-03-01 US disclosed
US-20050014761-A1 Intermediate compounds for making dihydropteridinones useful as pharmaceutical compositions BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG 2005-01-20 US disclosed
US-20050014760-A1 Methods of treating diseases or conditions using dihydropteridinone compounds BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2005-01-20 US disclosed
WO-2004076454-A1 DIHYDROPTERIDINONES, METHOD FOR THE PRODUCTION AND USE THEREOF IN THE FORM OF DRUGS BOEHRINGER INGELHEIM PHARMA GMBH & CO KG (DE) 2004-09-10 WO disclosed
US-20040176380-A1 New dihydropteridinones, processes for preparing them and their use as pharmaceutical compositions BOEHRINGER INGELHEIM PHARMA GMBH CO. KG (DE) 2004-09-09 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (8 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060035903-A1 Storage stable perfusion solution for dihydropteridinones QDPR, F5, F12 CHRM5 2245/4885ADRA2C 1306/4885KDM4E 4832/4885
US-20210047328-A1 PYRIMIDINE-BASED ANTIPROLIFERATIVE AGENTS TYMP, TYMS, DPYD CHRM5 4882/4885ADRA2C 4790/4885KDM4E 2045/4885
US-20040176380-A1 New dihydropteridinones, processes for preparing them and their use as pharmaceutical compositions QDPR, DHPS, DRD5 CHRM5 2219/4885ADRA2C 834/4885KDM4E 4006/4885
US-20050014760-A1 Methods of treating diseases or conditions using dihydropteridinone compounds QDPR, DHPS, DHFR CHRM5 1881/4885ADRA2C 1124/4885KDM4E 4721/4885
US-10829490-B2 Substituted dihydropyrazino[1 ′,2′:1,5]pyrrolo[2,3-d]pyrimidine-based antiproliferative agents MKI67, DPYD, PCNA CHRM5 4872/4885ADRA2C 4161/4885KDM4E 1307/4885
US-20060025411-A1 Methods for treating diseases or conditions using dihydropteridinone compounds QDPR, DHPS, DHFR CHRM5 1855/4885ADRA2C 970/4885KDM4E 4671/4885
US-20050014761-A1 Intermediate compounds for making dihydropteridinones useful as pharmaceutical compositions QDPR, DHPS, DHODH CHRM5 2095/4885ADRA2C 1566/4885KDM4E 4469/4885
US-20080293944-A1 Piperazinyl Compounds QDPR, DHPS, DPYD CHRM5 1481/4885ADRA2C 438/4885KDM4E 4088/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.