SCHEMBL2014239

SCHEMBL2014239

N#Cc1ccccn1.N#Cc1ccccn1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 6/20 0.45
KCNH2 Q12809 1/20 0.44
CYP1A2 P05177 4/20 0.43
KDM4E B2RXH2 1/20 0.43
LMNA P02545 1/20 0.43
POLB P06746 1/20 0.43
CCR1 P32246 1/20 0.43
CCR5 P51681 1/20 0.43
CCR8 P51685 1/20 0.43
METAP1 P53582 1/20 0.43
BLM P54132 1/20 0.43
HIF1A Q16665 1/20 0.43
DOHH Q9BU89 1/20 0.43
P4HTM Q9NXG6 1/20 0.43
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
USP2 O75604 1/20 0.42
ALDH1A1 P00352 1/20 0.42
GAA P10253 1/20 0.42
MAPT P10636 1/20 0.42

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
SCHEMBL29399634 1.00
SCHEMBL148839 1.00
Hydrochloric Acid SCHEMBL30978142 0.97 GRM5 (0.44) GRM5KCNH2CYP1A2KDM4ELMNA
SCHEMBL29119766 0.97
SCHEMBL30618918 0.97
SCHEMBL27446771 0.97
SCHEMBL27949300 0.97
Fluoride SCHEMBL28175628 0.97
Hydrochloric Acid SCHEMBL1967254 0.97 GRM5 (0.44) GRM5KCNH2CYP1A2KDM4ELMNA
Hydrochloric Acid SCHEMBL27946113 0.97

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2049492-B1 METHOD OF MAKING CYANOPYRIDINES DOW AGROSCIENCES LLC (US) 2010-01-27 EP claimed
US-20200190293-A1 RUBBER COMPOSITION, METHOD FOR MANUFACTURING RUBBER COMPOSITION, AND TIRE BRIDGESTONE CORPORATION (JP) 2020-06-18 US disclosed
EP-3608363-A1 RUBBER COMPOSITION, METHOD FOR PRODUCING RUBBER COMPOSITION, AND TIRE Bridgestone Corporation (JP) 2020-02-12 EP disclosed
CN-106083927-B Phosphino- amidine compound, metal complex, antigravity system and their oligomeric or olefin polymerization purposes 切弗朗菲利浦化学公司 2018-10-26 CN disclosed
US-8309657-B2 Rubber composition BRIDGESTONE CORPORATION (JP) 2012-11-13 US disclosed
CN-101528701-B Method for quenching gaseous reaction products containing cyanopyridines DOW AGROSCIENCES LLC 2011-10-19 CN disclosed
US-20110196086-A1 RUBBER COMPOSITION BRIDGESTONE CORPORATION (JP) 2011-08-11 US disclosed
EP-2336233-A1 RUBBER COMPOSITION Bridgestone Corporation (JP) 2011-06-22 EP disclosed
CN-101528701-A Method for quenching gaseous reaction products containing cyanopyridines DOW AGROSCIENCES LLC (US) 2009-09-09 CN disclosed