SCHEMBL7706747

SCHEMBL7706747

CN1CCN(c2ccc3c4c(cccc24)C(=O)OC3=O)CC1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD1 O95696 5/20 0.56
BRPF1 P55201 5/20 0.56
TAF1 P21675 4/20 0.56
KMT2A Q03164 11/20 0.55
MEN1 O00255 10/20 0.55
LMNA P02545 5/20 0.55
USP2 O75604 4/20 0.55
CASP1 P29466 3/20 0.55
SMN1; SMN2 Q16637 3/20 0.55
CASP7 P55210 2/20 0.55
GAA P10253 1/20 0.55
MAPK1 P28482 3/20 0.53
L3MBTL1 Q9Y468 3/20 0.53
RAB9A P51151 2/20 0.53
MAPT P10636 5/20 0.50
NPC1 O15118 1/20 0.50
AVPR1A P37288 1/20 0.50
EGFR P00533 1/20 0.48
TYMS P04818 2/20 0.47
BRD4 O60885 2/20 0.46

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
SCHEMBL17599254 0.86 MEN1 (0.60) BRD1BRPF1TAF1KMT2AMEN1
SCHEMBL14463491 0.84 BRD1 (0.55) BRD1BRPF1TAF1KMT2AMEN1
SCHEMBL29564392 0.84 MEN1 (0.62) BRD1BRPF1TAF1KMT2AMEN1
SCHEMBL1890453 0.84 MEN1 (0.62) BRD1BRPF1TAF1KMT2AMEN1
SCHEMBL7709644 0.83 BRD1 (0.60) BRD1BRPF1TAF1KMT2AMEN1
SCHEMBL6275389 0.80 KMT2A (0.62) BRD1BRPF1TAF1KMT2AMEN1
SCHEMBL28670264 0.79 MEN1 (0.81) BRD1BRPF1TAF1KMT2AMEN1
SCHEMBL29996049 0.79 MEN1 (0.81) BRD1BRPF1TAF1KMT2AMEN1
SCHEMBL38660071 0.79 MEN1 (0.67) KMT2AMEN1LMNAUSP2CASP1
SCHEMBL25036803 0.78 MEN1 (0.47) BRD1BRPF1TAF1KMT2AMEN1

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