SCHEMBL10377396

SCHEMBL10377396

CC1Cc2c(c3cccnc3n(-c3cccc(Cl)c3Cl)c2=O)O1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 10/20 0.38
HPGD P15428 4/20 0.36
MAPT P10636 3/20 0.36
CYP1A2 P05177 2/20 0.36
CYP2C19 P33261 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 2/20 0.36
MAPK1 P28482 1/20 0.36
DRD2 P14416 2/20 0.35
HTR2A P28223 2/20 0.35
HTR1A P08908 1/20 0.35
HTR7 P34969 1/20 0.35
HTR6 P50406 1/20 0.35
KCNH2 Q12809 1/20 0.35
HSD17B10 Q99714 1/20 0.35
BRD4 O60885 1/20 0.35
CREBBP Q92793 1/20 0.35
CYP3A4 P08684 1/20 0.34

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
SCHEMBL10377171 0.84 MAPT (0.38) HPGDMAPTCYP1A2CYP2C19MEN1
SCHEMBL9630898 0.84 HPGD (0.49) HPGDMAPTCYP1A2CYP2C19MEN1
SCHEMBL9629709 0.84 HPGD (0.40) HPGDMAPTCYP1A2CYP2C19MEN1
SCHEMBL10378372 0.84 HPGD (0.47) HPGDMAPTCYP1A2CYP2C19MEN1
SCHEMBL10378427 0.83 PTPN11 (0.38) PTPN11HPGDMAPTCYP1A2CYP2C19
SCHEMBL9630048 0.83 KAT2B (0.42) HPGDMAPTCYP1A2CYP2C19MEN1
SCHEMBL10739186 0.82 CREBBP (0.37) HPGDMAPTCYP1A2CYP2C19MEN1
SCHEMBL9629927 0.82 PDE4A (0.48) HPGDCYP1A2CYP2C19KDM4EALDH1A1
SCHEMBL10377462 0.81 PDE4B (0.42) HPGDMAPTCYP1A2CYP2C19MEN1
SCHEMBL10377474 0.81 HPGD (0.48) HPGDCYP1A2CYP2C19MEN1KMT2A

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-0127135-B1 FUSED TRICYCLIC DERIVATIVES OF NAPHTHYRIDINONE AND PYRIDONE AND THE CORRESPONDING THIONES SCHERING CORPORATION (US) 1990-08-29 EP disclosed
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