SCHEMBL7709992

SCHEMBL7709992

CC(C)(C)ON1C(=O)c2cccc3c(N4CCC(NC(=O)O)C4)ccc(c23)C1=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 9/20 0.45
BRD1 O95696 4/20 0.41
BRPF1 P55201 4/20 0.41
TAF1 P21675 3/20 0.41
MEN1 O00255 7/20 0.40
KMT2A Q03164 7/20 0.40
LMNA P02545 3/20 0.40
L3MBTL1 Q9Y468 3/20 0.39
MAPT P10636 3/20 0.39
RAB9A P51151 2/20 0.39
NPC1 O15118 1/20 0.39
AVPR1A P37288 1/20 0.39
MAPK1 P28482 1/20 0.39
USP2 O75604 3/20 0.38
HTT P42858 3/20 0.38
TLR9 Q9NR96 2/20 0.38
POLB P06746 1/20 0.38
PIM1 P11309 1/20 0.38
PIM3 Q86V86 1/20 0.38
PIM2 Q9P1W9 1/20 0.38

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
SCHEMBL7703741 0.84 MDM4 (0.39) BRD4KMT2ALMNAMAPTHTT
SCHEMBL7712210 0.74 MEN1 (0.38) BRD4BRD1BRPF1TAF1MEN1
SCHEMBL30273729 0.69 KMT2A (0.50) BRD4BRD1BRPF1TAF1MEN1
SCHEMBL7703836 0.69 SIGMAR1 (0.37) MTNR1AMTNR1B
SCHEMBL30273650 0.67 KDM4E (0.52) BRD4BRD1BRPF1TAF1MEN1
SCHEMBL7703797 0.67 ALDH1A1 (0.44) BRD4BRD1BRPF1MEN1KMT2A
SCHEMBL7709722 0.67 LMNA (0.36) MEN1KMT2ALMNAMAPTRAB9A
SCHEMBL7709632 0.67 CYP1B1 (0.58) MEN1KMT2ALMNAL3MBTL1MAPT
SCHEMBL4163672 0.66 MTNR1A (0.44) MTNR1AMTNR1B
SCHEMBL7709647 0.66 MAPT (0.48) BRD4BRD1BRPF1TAF1MEN1

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 2 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