SCHEMBL3209063

SCHEMBL3209063

CCNCCCOC(C)C

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 2/20 0.48
MEN1 O00255 1/20 0.48
GLA P06280 1/20 0.48
KMT2A Q03164 1/20 0.48
ALDH1A1 P00352 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
TSHR P16473 3/20 0.46
CYP1A2 P05177 1/20 0.46
SAT1 P21673 2/20 0.41
KDM1A O60341 5/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
HTT P42858 2/20 0.36

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
SCHEMBL25565761 0.87 ALDH1A1 (0.50) KMT2AALDH1A1SMN1; SMN2TSHRL3MBTL1
SCHEMBL4748879 0.85
SCHEMBL13612884 0.84 ALDH1A1 (0.45) KMT2AALDH1A1SMN1; SMN2TSHRL3MBTL1
SCHEMBL25565755 0.83 ALDH1A1 (0.47) CYP2C19KMT2AALDH1A1SMN1; SMN2TSHR
SCHEMBL25463224 0.82 ALDH1A1 (0.56) CYP2C19KMT2AALDH1A1SMN1; SMN2TSHR
SCHEMBL15510535 0.82 CYP2C19 (0.44) CYP2C19MEN1GLAKMT2AALDH1A1
SCHEMBL12245085 0.80 ALDH1A1 (0.54) KMT2AALDH1A1SMN1; SMN2TSHR
SCHEMBL6552923 0.80 ALDH1A1 (0.44) CYP2C19KMT2AALDH1A1SMN1; SMN2TSHR
SCHEMBL25832206 0.80 EPHX2 (0.35) CYP2C19MEN1GLAKMT2AALDH1A1
SCHEMBL25075483 0.79 ALDH1A1 (0.45) CYP2C19KMT2AALDH1A1SMN1; SMN2TSHR

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 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2708529-B1 METHOD FOR MANUFACTURING PARTICLES SUMITOMO CHEMICAL CO (JP) 2018-04-04 EP disclosed
US-9796831-B2 Process for producing particles SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-10-24 US disclosed
WO-2017181138-A1 PHOTODYNAMIC INSECTICIDES LEISHVAC LLC (US) 2017-10-19 WO disclosed
CN-103974929-B The manufacture method of the halogen acid salt of haloalkylamine 住友化学株式会社 2016-08-24 CN disclosed
CN-103534236-B Method for producing granules 住友化学株式会社 2016-08-17 CN disclosed
CN-103974929-A Method for producing hydrohalic acid salt of halogenated alkyl amine SUMITOMO CHEMICAL CO 2014-08-06 CN disclosed
EP-2708529-A1 METHOD FOR MANUFACTURING PARTICLES Sumitomo Chemical Company Limited (JP) 2014-03-19 EP disclosed
US-20140065337-A1 PROCESS FOR PRODUCING PARTICLES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-03-06 US disclosed
CN-103534236-A Method for producing granules SUMITOMO CHEMICAL CO 2014-01-22 CN disclosed
US-7671080-B2 1-benzylindole-2-carboxamide derivatives N.V. ORGANON (NL) 2010-03-02 US disclosed
US-20080280923-A1 1-Benzylindole-2-Carboxamide Derivatives N.V. ORGANON (NL) 2008-11-13 US disclosed
EP-1940788-A1 1-BENZYLINDOLE-2-CARBOXAMIDE DERIVATIVES N.V. Organon (NL) 2008-07-09 EP disclosed
WO-2006100208-A9 1-BENZYLINDOLE-2-CARBOXAMIDE DERIVATIVES ORGANON NV (NL) 2007-11-22 WO disclosed
WO-2006100208-A1 1-BENZYLINDOLE-2-CARBOXAMIDE DERIVATIVES N.V. ORGANON (NL) 2006-09-28 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 (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-20080280923-A1 1-Benzylindole-2-Carboxamide Derivatives CNR2, CNR1, HTR2C CYP2C19 332/4885MEN1 2868/4885GLA 2162/4885

“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.