SCHEMBL7967527

SCHEMBL7967527

O=C(O)c1cccc2c1OCC(=O)N2Cc1cncn1Cc1ccc(Cl)cc1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FNTA P49354 11/20 0.44
PGGT1B P53609 9/20 0.44
SLC5A2 P31639 2/20 0.44
MEN1 O00255 1/20 0.44
LMNA P02545 1/20 0.44
MAPT P10636 1/20 0.44
KMT2A Q03164 1/20 0.44
SLC5A1 P13866 1/20 0.42
CYP11B1 P15538 3/20 0.41
CYP11B2 P19099 3/20 0.41
FNTB P49356 4/20 0.41
HTR6 P50406 1/20 0.40
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
DRD4 P21917 1/20 0.40
NRAS P01111 1/20 0.39
HRAS P01112 1/20 0.39

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
SCHEMBL7971545 0.92 FNTA (0.47) FNTAPGGT1BMEN1LMNAMAPT
SCHEMBL7971733 0.92 KMT2A (0.41) FNTAPGGT1BSLC5A2MEN1LMNA
SCHEMBL7971101 0.82 FNTA (0.48) FNTAPGGT1BCYP11B1CYP11B2FNTB
SCHEMBL7971118 0.76 CYP11B1 (0.42) FNTAPGGT1BCYP11B1CYP11B2FNTB
SCHEMBL7971638 0.74 FNTA (0.47) FNTAPGGT1BMAPTCYP11B1CYP11B2
SCHEMBL7968423 0.74 FNTA (0.49) FNTAPGGT1BCYP11B1CYP11B2FNTB
SCHEMBL7968966 0.70 FNTA (0.44) FNTAPGGT1BCYP11B1CYP11B2FNTB
SCHEMBL4678786 0.70 HTR6 (0.53) SLC5A2MEN1LMNAMAPTKMT2A
SCHEMBL7967524 0.69 CPA1 (0.37) SLC5A2MEN1LMNAMAPTKMT2A
SCHEMBL12900268 0.69 MEN1 (0.50) SLC5A2MEN1LMNAMAPTKMT2A

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