SCHEMBL9084909

SCHEMBL9084909

Cc1c(F)c(F)c(Cl)c(F)c1C1=NC(C)(C)CO1

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.38
HTT P42858 2/20 0.35
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
ATM Q13315 2/20 0.34
ALDH1A1 P00352 1/20 0.33

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
SCHEMBL9089557 0.87 KDM4E (0.42) KDM4EHTTLMNAMAPTATM
SCHEMBL9085324 0.87 KDM4E (0.42) KDM4EHTTLMNAMAPTATM
SCHEMBL8624063 0.81 KDM4E (0.38) KDM4EHTTLMNAMAPTATM
SCHEMBL9088638 0.81 KDM4E (0.38) KDM4EHTTLMNAMAPTATM
SCHEMBL9090437 0.81 KDM4E (0.38) KDM4EHTTLMNAMAPTATM
SCHEMBL9088605 0.79 KDM4E (0.36) KDM4EHTTLMNAMAPT
SCHEMBL9088744 0.78 HTT (0.43) KDM4EHTTLMNAMAPTATM
SCHEMBL8630585 0.76 KDM4E (0.47) KDM4EHTTLMNAMAPTATM
SCHEMBL9089133 0.76 MAPT (0.47) KDM4EHTTLMNAMAPTALDH1A1
SCHEMBL8311060 0.71 KDM4E (0.37) KDM4EHTTLMNAMAPTATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5585491-A Antibacterial agents OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1996-12-17 US 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