SCHEMBL8112475

SCHEMBL8112475

CCc1c(F)c(F)c(F)c2c1c(=O)c(C(=O)O)cn2C1CC1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.56
▸ KMT2A Q03164 1/20 0.56
▸ GSK3B P49841 11/20 0.54
▸ TOP2A P11388 5/20 0.54
▸ TOP2B Q02880 5/20 0.54
▸ CACNA1F O60840 1/20 0.53
▸ POLB P06746 1/20 0.53
▸ MAPK1 P28482 1/20 0.53
▸ CACNA1D Q01668 1/20 0.53
▸ KCNH2 Q12809 1/20 0.53
▸ CACNA1S Q13698 1/20 0.53
▸ CACNA1C Q13936 1/20 0.53

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
SCHEMBL8111795 0.86 STAT3 (0.54) MEN1KMT2AGSK3BTOP2ATOP2B
SCHEMBL14143513 0.86 GSK3B (0.55) MEN1KMT2AGSK3BTOP2ATOP2B
SCHEMBL1344780 0.86 MEN1 (0.68) MEN1KMT2AGSK3BTOP2ATOP2B
SCHEMBL8557708 0.85 MEN1 (0.57) MEN1KMT2AGSK3BTOP2ATOP2B
SCHEMBL13585859 0.85 GSK3B (0.66) MEN1KMT2AGSK3BTOP2ATOP2B
SCHEMBL9234629 0.85 MEN1 (0.51) MEN1KMT2AGSK3BTOP2ATOP2B
SCHEMBL8557952 0.84 MEN1 (0.58) MEN1KMT2AGSK3BTOP2ATOP2B
SCHEMBL5868648 0.84 GSK3B (0.60) MEN1KMT2AGSK3BTOP2ATOP2B
SCHEMBL8116699 0.82 POLB (0.58) MEN1KMT2AGSK3BTOP2ATOP2B
SCHEMBL6216504 0.82 MEN1 (0.58) MEN1KMT2AGSK3BTOP2ATOP2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0565132-B1 Benzoheterocyclic compounds OTSUKA PHARMA CO LTD (JP) 2000-10-25 — — EP disclosed
EP-0823413-A2 Benzoheterocyclic compounds OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1998-02-11 — — EP disclosed
US-5591744-A 1,4-DIHYDRO-4-OXOQUINOLINE-3-CARBOXYLATE DERIVATIVES; MICROBIOCIDES OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) 1997-01-07 — — US disclosed
US-5585491-A Antibacterial agents OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1996-12-17 — — US disclosed
EP-0287951-B1 7-Piperazinyl- or 7-Morpholino-4-oxo-quinoline-3-carboxylic acid derivatives, their preparation and their use as antimicrobial agents OTSUKA PHARMA CO LTD (JP) 1996-07-03 — — EP disclosed
US-5495020-A CHEMICAL INTERMEDIATE FOR BACTERICIDES, MICROBIOCIDES, DISINFECTANTS; SIDE EFFECT REDUCTION, ABSORPTION OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) 1996-02-27 — — US disclosed
EP-0565132-A2 Benzoheterocyclic compounds OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1993-10-13 — — EP disclosed
EP-0398967-A1 ANTIBACTERIAL AGENTS WARNER-LAMBERT COMPANY (US) 1990-11-28 — — EP disclosed
US-4920120-A 3-CARBOXY, 4-OXO, 6-FLUORO, 7-NITROGEN-CONTAINING RING 1,4-DIHYDRO-1,8-NAPHTHYRIDINES WARNER-LAMBERT COMPANY (US) 1990-04-24 — — US disclosed
EP-0326891-A2 Antibacterial agents WARNER-LAMBERT COMPANY (US) 1989-08-09 — — EP disclosed
WO-1989006649-A2 ANTIBACTERIAL AGENTS WARNER-LAMBERT COMPANY (US) 1989-07-27 — — WO disclosed
EP-0287951-A2 7-Piperazinyl- or 7-Morpholino-4-oxo-quinoline-3-carboxylic acid derivatives, their preparation and their use as antimicrobial agents OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1988-10-26 — — EP disclosed
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