SCHEMBL10659533

SCHEMBL10659533

O=c1c2c(n(Cc3cccs3)c3ncccc13)OCCC2

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.43
THRB P10828 1/20 0.41
ALDH1A1 P00352 9/20 0.39
TSHR P16473 7/20 0.39
CYP1A2 P05177 9/20 0.39
CYP3A4 P08684 9/20 0.39
CYP2D6 P10635 6/20 0.39
CYP2C9 P11712 6/20 0.39
CYP2C19 P33261 4/20 0.39
HSD17B10 Q99714 4/20 0.39
USP2 O75604 3/20 0.39
CLK4 Q9HAZ1 3/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
HPGD P15428 4/20 0.37
CASP1 P29466 2/20 0.36
CASP7 P55210 1/20 0.36
LMNA P02545 2/20 0.35
MAPK1 P28482 1/20 0.35
HIF1A Q16665 1/20 0.35

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
SCHEMBL10658805 0.94 MAPT (0.45) MAPTTHRBALDH1A1TSHRCYP1A2
SCHEMBL10657054 0.84 ENPP2 (0.43) MAPTTHRBMEN1KMT2ATP53
SCHEMBL10656189 0.83 MAPT (0.46) MAPTTHRBALDH1A1TSHRCYP1A2
SCHEMBL10662052 0.82 MEN1 (0.40) MAPTALDH1A1TSHRHSD17B10MEN1
SCHEMBL10657699 0.77 PLK1 (0.43) MAPTALDH1A1CYP1A2CYP3A4CYP2C9
SCHEMBL10654623 0.77 HRH1 (0.42) HSD17B10
SCHEMBL10659571 0.77 PTGDR2 (0.45) MAPTMEN1KMT2ATP53
SCHEMBL10657891 0.76 MAPT (0.47) MAPTTHRBALDH1A1TSHRCYP1A2
SCHEMBL10659228 0.76 ACHE (0.36) MAPTALDH1A1HSD17B10MEN1KMT2A
SCHEMBL10656163 0.75 MEN1 (0.42) MAPTALDH1A1TSHRCYP1A2HSD17B10

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