SCHEMBL509140

SCHEMBL509140

CCN(CC)C(=O)c1cc(C)ccc1C

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.54
TDP1 Q9NUW8 1/20 0.54
SMN1; SMN2 Q16637 4/20 0.50
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
LMNA P02545 1/20 0.50
TSHR P16473 2/20 0.49
MAPK1 P28482 1/20 0.49
HSP90AA1 P07900 4/20 0.45
HSP90AB1 P08238 4/20 0.45
KEAP1 Q14145 1/20 0.41
UTS2R Q9UKP6 1/20 0.40
CSNK2A1 P68400 1/20 0.40

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
SCHEMBL509845 0.85 HPGD (0.58) HPGDTDP1SMN1; SMN2MEN1KMT2A
SCHEMBL18570098 0.84 HSP90AA1 (0.64) HPGDTDP1SMN1; SMN2MEN1KMT2A
SCHEMBL471668 0.82 HPGD (0.51) HPGDTDP1SMN1; SMN2MEN1KMT2A
SCHEMBL4472813 0.82 HPGD (0.51) HPGDTDP1SMN1; SMN2MEN1KMT2A
SCHEMBL17877022 0.82 HPGD (0.53) HPGDTDP1SMN1; SMN2MEN1KMT2A
SCHEMBL1034975 0.82 HPGD (0.49) HPGDTDP1SMN1; SMN2MEN1KMT2A
SCHEMBL12677875 0.82 HPGD (0.51) HPGDTDP1SMN1; SMN2MEN1KMT2A
SCHEMBL6648687 0.82 ALDH1A1 (0.51) HPGDTDP1SMN1; SMN2MEN1KMT2A
SCHEMBL10082156 0.82 USP2 (0.57) HPGDTDP1SMN1; SMN2MEN1KMT2A
SCHEMBL7225379 0.82 HPGD (0.49) HPGDTDP1SMN1; SMN2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220386582-A1 METHOD AND DEVICE TO TRAP ACARIDS DOMOBIOS (BE) 2022-12-08 US disclosed
US-20210161130-A1 COMPOSITIONS FOR ATTRACTING PESTS AND USES THEREOF DOMOBIOS (BE) 2021-06-03 US disclosed
EP-3813530-A1 COMPOSITIONS FOR ATTRACTING PESTS AND USES THEREOF Domobios (BE) 2021-05-05 EP disclosed
US-20200344991-A1 METHOD AND DEVICE TO TRAP ACARIDS DOMOBIOS (BE) 2020-11-05 US disclosed
EP-3253203-B1 METHOD AND DEVICE TO TRAP ACARIDS DOMOBIOS (BE) 2020-10-28 EP disclosed
US-20180027793-A1 METHOD AND DEVICE TO TRAP ACARIDS DOMOBIOS (BE) 2018-02-01 US disclosed
US-9447134-B2 Compounds and methods for treating mammalian gastrointestinal microbial infections BRANDEIS UNIVERSITY (US) 2016-09-20 US disclosed
WO-2016124566-A1 METHOD AND DEVICE TO TRAP ACARIDS DOMOBIOS (BE) 2016-08-11 WO disclosed
US-20150210727-A1 COMPOUNDS AND METHODS FOR TREATING MAMMALIAN GASTROINTESTINAL MICROBIAL INFECTIONS THE BRIGHAM AND WOMEN'S HOSPITAL, INC. (US) 2015-07-30 US disclosed
CN-102532020-B 5, 6, or 7-substituted -3-(hetero) arylisoquinolinamine derivatives REXAHN PHARMACEUTICALS INC 2015-02-25 CN disclosed
US-20080182871-A1 5, 6, or 7-Substituted - 3-(hetero) arylisoquinolinamine derivatives and therapeutic use thereof REXAHN PHARMACEUTICALS, INC. (US) 2008-07-31 US disclosed
WO-2008063548-A2 5, 6, OR 7-SUBSTITUTED-S- (HETERO)ARYLISOQUINOLINAMINE DERIVATIVES AS ANTITUMOR AGENTS REXAHN PHARMACEUTICALS, INC. (US) 2008-05-29 WO disclosed
EP-1813596-A1 PROCESS FOR PRODUCING ALPHA, ALPHA- DIFLUOROAMINE National University Corporation Hokkaido University (JP) 2007-08-01 EP disclosed
US-20040176361-A1 Fused heterocyclic compound and medicinal use thereof MITSUBISHI PHARMA CORPORATION (JP) 2004-09-09 US disclosed
EP-1396488-A1 FUSED HETEROCYCLIC COMPOUND AND MEDICINAL USE THEREOF Mitsubishi Pharma Corporation (JP) 2004-03-10 EP disclosed
US-6447801-B1 COMPRISING LIPOSOMES HAVING PHOSPHOTIDE MEMBRANES ENCLOSING WATER SOLUBLE ANTHELMINTIC DRUGS USED AS INSECT REPELLANTS AND FOR PREVENTION OF SCHISTOSOMIASIS SALAFSKY BERNARD (US) 2002-09-10 US disclosed
EP-0963198-A4 ANTI-PARASITIC ACTION OF N,N-DIETHYL-m-TOLUAMIDE (DEET) AND FORMULATIONS THAT PROLONG ITS ACTIVITY IN THE SKIN SALAFSKY BERNARD (US) 2001-08-29 EP disclosed
CN-1253774-A Antiparasitic composition containing N, N-diethyl-m-toluamide BONERDER SARAFSKI (US) 2000-05-24 CN disclosed
EP-0963198-A1 ANTI-PARASITIC ACTION OF N,N-DIETHYL-m-TOLUAMIDE (DEET) AND FORMULATIONS THAT PROLONG ITS ACTIVITY IN THE SKIN Salafsky, Bernard (US) 1999-12-15 EP disclosed
WO-1998034604-A1 ANTI-PARASITIC ACTION OF N,N-DIETHYL-m-TOLUAMIDE (DEET) AND FORMULATIONS THAT PROLONG ITS ACTIVITY IN THE SKIN SALAFSKY BERNARD (US) 1998-08-13 WO 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 (4 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-20080182871-A1 5, 6, or 7-Substituted - 3-(hetero) arylisoquinolinamine derivatives and therapeutic use thereof FANCD2, NRAS, CCND2 HPGD 204/4885TDP1 1459/4885SMN1; SMN2 4489/4885
US-20150210727-A1 COMPOUNDS AND METHODS FOR TREATING MAMMALIAN GASTROINTESTINAL MICROBIAL INFECTIONS IMPDH1, IMPDH2, IMPA1 HPGD 45/4885TDP1 2345/4885SMN1; SMN2 4091/4885
US-20040176361-A1 Fused heterocyclic compound and medicinal use thereof PARP11, PARP1, CD38 HPGD 77/4885TDP1 737/4885SMN1; SMN2 1795/4885
US-20210161130-A1 COMPOSITIONS FOR ATTRACTING PESTS AND USES THEREOF ACAT1, ATL3, NISCH HPGD 4312/4885TDP1 4207/4885SMN1; SMN2 2623/4885

“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.