SCHEMBL8908317

SCHEMBL8908317

COC(=O)c1cccc(NC(C)=O)c1C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.50
LMNA P02545 2/20 0.50
CYP2C19 P33261 2/20 0.50
MAPT P10636 4/20 0.49
ALOX15 P16050 1/20 0.49
KMT2A Q03164 1/20 0.49
KDM4E B2RXH2 5/20 0.49
ATM Q13315 1/20 0.49
SMN1; SMN2 Q16637 3/20 0.47
ALDH1A1 P00352 6/20 0.47
HTT P42858 2/20 0.47
HSD17B10 Q99714 3/20 0.46
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
GAA P10253 3/20 0.44
TSHR P16473 3/20 0.44
MAPK10 P53779 1/20 0.44
MAPK1 P28482 1/20 0.44
CYP2C9 P11712 1/20 0.44
HPGD P15428 1/20 0.44

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
SCHEMBL31590548 0.90 LMNA (0.53) POLBLMNACYP2C19MAPTALOX15
SCHEMBL4026343 0.90 LMNA (0.53) POLBLMNACYP2C19MAPTALOX15
SCHEMBL28926278 0.87 POLB (0.50) POLBLMNACYP2C19MAPTALOX15
SCHEMBL30346643 0.86 POLB (0.56) POLBLMNACYP2C19KMT2AKDM4E
SCHEMBL11593694 0.86 POLB (0.56) POLBLMNACYP2C19KMT2AKDM4E
SCHEMBL29065716 0.85 LMNA (0.52) LMNACYP2C19MAPTKMT2AKDM4E
SCHEMBL9377084 0.85 POLB (0.54) POLBCYP2C19KMT2AKDM4ESMN1; SMN2
SCHEMBL8669430 0.82 TSHR (0.55) POLBLMNAMAPTALOX15KMT2A
SCHEMBL26699195 0.82 KMT2A (0.55) POLBMAPTALOX15KMT2AKDM4E
SCHEMBL1640485 0.81 KMT2A (0.71) POLBLMNACYP2C19MAPTALOX15

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
WO-1997047589-A1 AMINOPHTHALIC ACID DERIVATIVES BAYER AKTIENGESELLSCHAFT (DE) 1997-12-18 WO claimed
JP-4182460-A None JP disclosed
JP-8012635-A None JP disclosed
JP-H0812635-A PRODUCTION OF ACYLAMINOPHTHALIC ACID DERIVATIVE SUMITOMO CHEM CO LTD 1996-01-16 JP disclosed
JP-H04182460-A ANILIDE DERIVATIVE AND PREPARATION THEREOF SUMITOMO CHEM CO LTD 1992-06-30 JP disclosed