SCHEMBL10656144

SCHEMBL10656144

Cc1nc2c3c(c(=O)n(-c4ccc(F)cc4)c2nc1C)CCO3

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.38
SMN1; SMN2 Q16637 5/20 0.37
TSHR P16473 5/20 0.37
HTT P42858 2/20 0.37
HKDC1 Q2TB90 1/20 0.36
HSD17B10 Q99714 2/20 0.34
KDM4E B2RXH2 3/20 0.34
ALDH1A1 P00352 5/20 0.33
CYP1A2 P05177 3/20 0.33
USP2 O75604 2/20 0.33
CASP1 P29466 2/20 0.33
CASP7 P55210 2/20 0.33
HIF1A Q16665 2/20 0.33
MAPK1 P28482 2/20 0.33
NPSR1 Q6W5P4 1/20 0.33
HPGD P15428 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
CRHR1 P34998 1/20 0.33

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
SCHEMBL10657373 0.93 POLB (0.36) POLBSMN1; SMN2TSHRHTTHKDC1
SCHEMBL10658078 0.81 SMN1; SMN2 (0.34) POLBSMN1; SMN2TSHRHTTHKDC1
SCHEMBL10379002 0.81 HPGD (0.35) POLBSMN1; SMN2TSHRHSD17B10ALDH1A1
SCHEMBL10657805 0.79 ALDH1A1 (0.40) POLBSMN1; SMN2TSHRHTTHKDC1
SCHEMBL10658752 0.79 EPHB4 (0.45) SMN1; SMN2TSHRHTTALDH1A1CYP1A2
SCHEMBL10659049 0.78 HPGD (0.35) SMN1; SMN2TSHRHTTKDM4EALDH1A1
SCHEMBL10659042 0.75 EPHB4 (0.34) KDM4EALDH1A1HPGD
SCHEMBL10658485 0.75 HPGD (0.37) SMN1; SMN2HKDC1KDM4EALDH1A1MAPK1
SCHEMBL10654050 0.74 KDM4E (0.36) POLBSMN1; SMN2TSHRHTTHKDC1
SCHEMBL10659635 0.74 CYP1A2 (0.39) POLBTSHRKDM4EALDH1A1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4740511-A ANTIALLERGENS, ANTIINFLAMMATORY, ANTIULCER AGENTS SCHERING CORPORATION (US) 1988-04-26 US disclosed
US-4680298-A Tricyclic anti-allergy and use as anti-inflammatory agents SCHERING CORPORATION (US) 1987-07-14 US disclosed
US-4680297-A Tricyclic positive inotropic agents SCHERING CORPORATION (US) 1987-07-14 US disclosed
EP-0127135-A2 Fused tricyclic derivatives of naphthyridinone and pyridone and the corresponding thiones SCHERING CORPORATION (US) 1984-12-05 EP disclosed