SCHEMBL10656830

SCHEMBL10656830

CC1Cc2c(n(CCc3ccccc3)c3ncccc3c2=O)O1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 1/20 0.42
HDAC1 Q13547 1/20 0.41
HDAC11 Q96DB2 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
MAPT P10636 2/20 0.40
TP53 P04637 1/20 0.40
ALDH1A1 P00352 4/20 0.38
TSHR P16473 4/20 0.38
MAPK1 P28482 3/20 0.38
LMNA P02545 3/20 0.38
CYP1A2 P05177 2/20 0.38
CYP2D6 P10635 2/20 0.38
CYP2C9 P11712 2/20 0.38
CYP2C19 P33261 2/20 0.38
HSD17B10 Q99714 2/20 0.38
CLK4 Q9HAZ1 2/20 0.38
CASP1 P29466 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
SCHEMBL10658802 0.89 PTGDR2 (0.45) MEN1KMT2AENPP2PTGDR2PDE4A
SCHEMBL10658218 0.84 DHFR (0.44) MEN1KMT2AMAPTALDH1A1TSHR
SCHEMBL10655505 0.83 PLK1 (0.44) PLK1HDAC1HDAC11HDAC8HDAC6
SCHEMBL10659526 0.79 PLK1 (0.44) PLK1HDAC1HDAC11HDAC8HDAC6
SCHEMBL9629995 0.79 FEN1 (0.44) ALDH1A1TSHRCYP2C19PDE4APDE4B
SCHEMBL10657699 0.77 PLK1 (0.43) PLK1HDAC1HDAC11HDAC8HDAC6
SCHEMBL10658199 0.76 P2RX4 (0.55) MEN1KMT2AMAPTALDH1A1MAPK1
SCHEMBL10657751 0.74 CNR1 (0.46) HDAC1HDAC11HDAC8HDAC6MEN1
SCHEMBL9630915 0.72 HPGD (0.38) MEN1KMT2AMAPTCYP1A2CYP2C9
SCHEMBL9629009 0.72 HPGD (0.44) KMT2ATP53ALDH1A1TSHRCYP1A2

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