SCHEMBL9806509

SCHEMBL9806509

COC(=O)c1ccccc1Nc1cccc(CN(O)C(C)=O)c1C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.49
ALOX15 P16050 1/20 0.49
KMT2A Q03164 3/20 0.46
KDM4E B2RXH2 2/20 0.46
POLB P06746 1/20 0.46
ATM Q13315 1/20 0.46
MAPK8 P45983 1/20 0.44
MAPK9 P45984 1/20 0.44
MAPK10 P53779 1/20 0.44
CDC25B P30305 4/20 0.44
CDC25A P30304 1/20 0.44
CDC25C P30307 1/20 0.44
ALDH1A1 P00352 3/20 0.44
LMNA P02545 3/20 0.44
PTGS2 P35354 3/20 0.44
MEN1 O00255 2/20 0.44
CYP1A2 P05177 2/20 0.44
CYP3A4 P08684 2/20 0.44
CYP2C9 P11712 2/20 0.44
AKR1C3 P42330 2/20 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
SCHEMBL9806495 0.89 MAPT (0.46) MAPTALOX15KMT2AKDM4EPOLB
SCHEMBL9806488 0.88 CDC25B (0.49) MAPTALOX15KMT2AKDM4EPOLB
SCHEMBL9806532 0.87 AKR1C3 (0.59) MAPTKMT2AKDM4EPOLBMAPK8
SCHEMBL9806505 0.86 PTGS2 (0.48) MAPTALOX15KMT2AKDM4EPOLB
SCHEMBL9806533 0.81 MAPT (0.52) MAPTALOX15KMT2AKDM4EPOLB
SCHEMBL7346692 0.78 PTGS2 (0.52) MAPTKMT2APOLBLMNAPTGS2
SCHEMBL9806483 0.77 MEN1 (0.53) MAPTKMT2AKDM4EPOLBMAPK8
SCHEMBL9806503 0.77 CDC25B (0.47) MAPTALOX15KMT2AKDM4EPOLB
SCHEMBL30593451 0.77 PTGS2 (0.71) MAPTALOX15KMT2AKDM4EPOLB
SCHEMBL11344390 0.77 PTGS2 (0.71) MAPTALOX15KMT2AKDM4EPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5017604-A Antiinflammatory WARNER-LAMBERT COMPANY (US) 1991-05-21 US claimed