SCHEMBL7967524

SCHEMBL7967524

O=C(O)c1cccc2c1OCC(=O)N2C(Cc1ccc(Cl)cc1)c1cnc[nH]1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CPA1 P15085 1/20 0.37
SLC5A2 P31639 2/20 0.35
LMNA P02545 2/20 0.33
MAPT P10636 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
CPB2 Q96IY4 5/20 0.32
CPB1 P15086 1/20 0.32
NLN Q9BYT8 1/20 0.32
TSHR P16473 1/20 0.32
SLC5A1 P13866 1/20 0.31
HTR6 P50406 1/20 0.31
S1PR1 P21453 1/20 0.31
HIF1A Q16665 1/20 0.31
BRS3 P32247 1/20 0.30
DRD4 P21917 1/20 0.30
FTO Q9C0B1 1/20 0.30

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
SCHEMBL7971730 0.91 CPA1 (0.37) CPA1KMT2ACPB2CPB1HIF1A
SCHEMBL7971542 0.91 CPA1 (0.39) CPA1LMNAMAPTMEN1KMT2A
SCHEMBL7971099 0.83 CPA1 (0.38) CPA1LMNAMAPTCPB2CPB1
SCHEMBL7971115 0.78 CPA1 (0.36) CPA1CPB2CPB1NLN
SCHEMBL7968421 0.74 CPA1 (0.40) CPA1CPB2CPB1
SCHEMBL7971636 0.74 CPA1 (0.38) CPA1CPB2CPB1BRS3
SCHEMBL7974145 0.70 CPA1 (0.36) CPA1CPB2CPB1BRS3
SCHEMBL7967527 0.69 FNTA (0.44) SLC5A2LMNAMAPTMEN1KMT2A
SCHEMBL7973949 0.66 FTO (0.42) CPA1LMNAMAPTMEN1KMT2A
SCHEMBL1339079 0.62 SLC6A4 (0.41) MEN1KMT2A

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
WO-2001009127-A1 BENZOXAZINE DERIVATIVES AND THEIR THERAPEUTIC USE AVENTIS PHARMA S.A. (FR) 2001-02-08 WO disclosed