SCHEMBL7706716

SCHEMBL7706716

O=C1c2cccc3cc(Br)cc(c23)C(=O)N1OCc1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.57
CYP1B1 Q16678 1/20 0.56
KMT2A Q03164 3/20 0.50
RXFP1 Q9HBX9 1/20 0.48
MEN1 O00255 2/20 0.48
TDP1 Q9NUW8 1/20 0.46
NPSR1 Q6W5P4 2/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
MAPK1 P28482 1/20 0.45
BRD1 O95696 1/20 0.44
TAF1 P21675 1/20 0.44
BRPF1 P55201 1/20 0.44
KDM4E B2RXH2 3/20 0.44
ALDH1A1 P00352 3/20 0.44
GAA P10253 1/20 0.44
RAB9A P51151 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
CLTC Q00610 2/20 0.43
HPGD P15428 2/20 0.42

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
SCHEMBL7703791 0.86 MAPT (0.49) MAPTKMT2AMEN1TDP1NPSR1
SCHEMBL7703774 0.86 TDP1 (0.50) MAPTCYP1B1KMT2AMEN1TDP1
SCHEMBL7709423 0.81 NTRK1 (0.57) MAPTKMT2AMEN1TDP1BRD1
SCHEMBL7709479 0.77 TDP1 (0.42) MAPTKMT2AMEN1TDP1NPSR1
SCHEMBL6524461 0.77 KMT2A (0.74) MAPTKMT2AMEN1CYP2C9MAPK1
SCHEMBL29367470 0.77 KMT2A (0.74) MAPTKMT2AMEN1CYP2C9MAPK1
SCHEMBL7712257 0.77 MEN1 (0.46) MAPTCYP1B1KMT2AMEN1TDP1
SCHEMBL9671915 0.76 MEN1 (0.56) MAPTKMT2AMEN1CYP2C9ALDH1A1
SCHEMBL7712197 0.76 CYP1B1 (0.65) MAPTCYP1B1KMT2ARXFP1MEN1
SCHEMBL7711959 0.76 MCHR1 (0.45) MAPTKMT2AMEN1TDP1NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6362181-B1 BACTERICIDES; ENZYME INHIBITORS; ANTITUMOR AGENTS WARNER-LAMBERT COMPANY 2002-03-26 US disclosed
US-6177423-B1 N-(HYDROXY OR PROTECTED HYDROXY)-BENZO(DE)ISOQUINOLINE-1,3-DIONE DERIVATIVES; BACTERIAL DNA GYRASE AND DNA TOPOISOMERASE INHIBITORS USEFUL FOR ANTIBACTERIAL AGENTS HAVING REDUCED DRUG RESISTANCE AND REDUCED SIDE EFFECTS WARNER-LAMBERT COMPANY 2001-01-23 US disclosed
EP-0939754-A2 N-OXY-NAPHTHALIMIDES AS ANTIBACTERIAL AGENTS WARNER-LAMBERT COMPANY (US) 1999-09-08 EP disclosed
WO-1998019648-A2 N-OXY-NAPHTHALIMIDES AS ANTIBACTERIAL AGENTS WARNER-LAMBERT COMPANY (US) 1998-05-14 WO disclosed