SCHEMBL10978490

SCHEMBL10978490

COC(=O)CCCCc1ccc(CN)nc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 1/20 0.43
PDE3A Q14432 1/20 0.43
P2RY12 Q9H244 1/20 0.43
FAAH O00519 2/20 0.40
HPGD P15428 1/20 0.40
CES1 P23141 1/20 0.40
EPHX2 P34913 1/20 0.39
TSHR P16473 2/20 0.38
MAPT P10636 2/20 0.38
ALDH1A1 P00352 2/20 0.38
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 1/20 0.38
LMNA P02545 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
PKM P14618 1/20 0.38
ALOX15 P16050 1/20 0.38
NFKB1 P19838 1/20 0.38
THPO P40225 1/20 0.38
BLM P54132 1/20 0.38

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
SCHEMBL27594121 0.89 PDE3B (0.41) PDE3BPDE3AP2RY12FAAHHPGD
SCHEMBL10979090 0.82 PDE3B (0.40) PDE3BPDE3AP2RY12FAAHHPGD
SCHEMBL28193122 0.81 MBOAT4 (0.51) HPGDTSHRMAPTALDH1A1LMNA
SCHEMBL28275792 0.81 LOXL2 (0.51) PDE3BPDE3AP2RY12HPGDEPHX2
SCHEMBL10974800 0.77 CYP11B1 (0.43) PDE3BPDE3AP2RY12FAAHHPGD
SCHEMBL1410550 0.77 CYP4F2 (0.42) MAPTALDH1A1KDM4ELMNAKMT2A
SCHEMBL18291564 0.77 POLB (0.45) HPGDTSHRMAPTALDH1A1KDM4E
SCHEMBL10978511 0.76 PDE3B (0.41) PDE3BPDE3AP2RY12TSHRMAPT
SCHEMBL4832980 0.76 LOXL2 (0.53) EPHX2TSHRMAPTALDH1A1LMNA
SCHEMBL22242096 0.75 CYP11B1 (0.41) TSHRALDH1A1L3MBTL1MBOAT4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0068386-B1 SUBSTITUTED IMIDAZO(1,5-A)PYRIDINES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL PREPARATIONS CONTAINING THESE COMPOUNDS CIBA-GEIGY AG (CH) 1985-12-18 EP disclosed
US-4470986-A ISCHEMIA, SHOCK, THROMBOSIS CIBA-GEIGY CORPORATION (US) 1984-09-11 US disclosed
EP-0114572-A1 Substituted imidazo(1,5-a)pyridines CIBA-GEIGY AG (CH) 1984-08-01 EP disclosed
US-4444775-A ENZYME INHIBITORS CIBA-GEIGY CORPORATION (US) 1984-04-24 US disclosed
EP-0068386-A1 Substituted imidazo(1,5-a)pyridines, process for their preparation and pharmaceutical preparations containing these compounds CIBA-GEIGY AG (CH) 1983-01-05 EP disclosed