SCHEMBL1399548

SCHEMBL1399548

CN1CCN(Nc2ccccc2)CC1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.56
KDM4E B2RXH2 2/20 0.47
MC4R P32245 2/20 0.44
CHRM2 P08172 1/20 0.44
CHRM4 P08173 1/20 0.44
CHRM5 P08912 1/20 0.44
ADRA2A P08913 1/20 0.44
ADORA3 P0DMS8 1/20 0.44
CYP2D6 P10635 1/20 0.44
CHRM1 P11229 1/20 0.44
CHRM3 P20309 1/20 0.44
DRD1 P21728 1/20 0.44
ADRA1D P25100 1/20 0.44
HTR2A P28223 1/20 0.44
HTR2C P28335 1/20 0.44
HRH1 P35367 1/20 0.44
OPRM1 P35372 1/20 0.44
DRD3 P35462 1/20 0.44
HTR2B P41595 1/20 0.44
SLC6A3 Q01959 1/20 0.44

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
SCHEMBL4055295 0.89 ALDH1A1 (0.43) SMN1; SMN2CYP2D6HTR2BKMT2ACYP2C19
SCHEMBL30997647 0.83 TSHR (0.49) SMN1; SMN2KDM4ECYP2D6OPRM1KMT2A
SCHEMBL30997646 0.83 TSHR (0.49) SMN1; SMN2KDM4ECYP2D6OPRM1KMT2A
SCHEMBL30730934 0.82 ACHE (0.42) SMN1; SMN2KDM4E
SCHEMBL1829575 0.79 KDM1A (0.46) SMN1; SMN2CYP2D6HTR2BKMT2ACYP2C19
SCHEMBL1752645 0.79 KDM1A (0.50) KDM4ECYP2D6HTR2BKCNH2KMT2A
SCHEMBL2234081 0.79 ADRA2C (0.52) SMN1; SMN2KDM4ECYP2D6KMT2APOLB
SCHEMBL5255784 0.79 CTSD (0.39) SMN1; SMN2HRH4
SCHEMBL1000959 0.79 L3MBTL1 (0.50) SMN1; SMN2CYP2D6KMT2APOLBCYP2C19
SCHEMBL1399603 0.78 CHRNA7 (0.53) SMN1; SMN2KDM4EADRA2AKMT2APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118924749-A Preparation method of chromone amide compound for Alzheimer disease drug 广西民族大学 2024-11-12 CN claimed
CN-115304550-A Piperazine phenyl amino substituted pyrimidine amino acid derivative, preparation method and application 南通大学 2022-11-08 CN claimed
CN-118924749-A Preparation method of chromone amide compound for Alzheimer disease drug 广西民族大学 2024-11-12 CN disclosed
EP-4419529-A1 COVALENT EGFR INHIBITORS AND METHODS OF USE THEREOF Dana-Farber Cancer Institute, Inc. (US) 2024-08-28 EP disclosed
CN-116829558-A Compounds of formula (I) 艾斯法姆生物技术股份有限公司 2023-09-29 CN disclosed
CN-115160340-B Small molecular compound with ACK1 inhibition activity and application thereof 四川大学华西医院 2023-07-21 CN disclosed
CN-116456985-A Pyrimidine and pyridine derivatives as HPK1 modulators and methods of use thereof 深圳市原力生命科学有限公司 2023-07-18 CN disclosed
WO-2023069959-A1 COVALENT EGFR INHIBITORS AND METHODS OF USE THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2023-04-27 WO disclosed
CN-115304550-A Piperazine phenyl amino substituted pyrimidine amino acid derivative, preparation method and application 南通大学 2022-11-08 CN disclosed
EP-3604306-B1 MACROCYCLIC DERIVATIVE OF PYRAZOL[3,4-D]PYRIMIDIN-3-ONE, PHARMACEUTICAL COMPOSITION AND USE THEREOF SHANGHAI DE NOVO PHARMATECH CO LTD (CN) 2022-10-26 EP disclosed
CN-115160340-A Small molecule compound with ACK1 inhibitory activity and application thereof 四川大学华西医院 2022-10-11 CN disclosed
CN-103121972-A Pyrimidine urea derivatives as kinase inhibitors NOVARTIS AG 2013-05-29 CN disclosed
WO-2013059485-A1 PYRIDOPYRIMIDINONE INHIBITORS OF KINASES ABBVIE INC. (US) 2013-04-25 WO disclosed
EP-2376491-A1 PYRROLOTRIAZINES AS ALK AND JAK2 INHIBITORS Cephalon, Inc. (US) 2011-10-19 EP disclosed
US-7956185-B2 Cyclobut-3-ene-1,2,-dione inhibitors of polo-like kinases ABBOTT LABORATORIES (US) 2011-06-07 US disclosed
EP-2086540-B8 TRIAZOLOPYRIDINE COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE & INFLAMMATORY DISEASES GALAPAGOS NV (BE) 2011-03-02 EP disclosed
WO-2010071885-A1 PYRROLOTRIAZINES AS ALK AND JAK2 INHIBITORS CEPHALON, INC. (US) 2010-06-24 WO disclosed
EP-2086540-A1 TRIAZOLOPYRIDINE COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE & INFLAMMATORY DISEASES Galapagos N.V. (BE) 2009-08-12 EP disclosed
WO-2008065198-A1 TRIAZOLOPYRIDINE COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE & INFLAMMATORY DISEASES GALAPAGOS N.V. (BE) 2008-06-05 WO disclosed
US-20080015192-A1 INHIBITORS OF POLO-LIKE KINASES ABBVIE INC. 2008-01-17 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 (1 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-20080015192-A1 INHIBITORS OF POLO-LIKE KINASES PLK1, PLK2, BUB1B SMN1; SMN2 2464/4885KDM4E 3120/4885MC4R 4780/4885

“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.