SCHEMBL7010109

SCHEMBL7010109

O=C(O)c1cn(CCF)c2nc(-c3ccc4c(c3)CNC4)c(F)cc2c1=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.46
CYP2C9 P11712 1/20 0.46
ATP6V1B2 P21281 1/20 0.46
TBXA2R P21731 1/20 0.46
EDNRA P25101 1/20 0.46
TARBP2 Q15633 1/20 0.46
KDM4E B2RXH2 3/20 0.44
ALDH1A1 P00352 3/20 0.44
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
ABCC4 O15439 1/20 0.39
PKM P14618 1/20 0.39
PTGS1 P23219 1/20 0.39
DRD3 P35462 1/20 0.38
TOP1 P11387 5/20 0.38
TSHR P16473 2/20 0.38
HPGD P15428 2/20 0.38
BRD4 O60885 1/20 0.38
HTT P42858 1/20 0.38
CYP2J2 P51589 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
SCHEMBL7011864 0.91 LMNA (0.58) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL7010392 0.87 KDM4E (0.48) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL7009246 0.83 DPP4 (0.49) LMNACYP2C9KDM4EALDH1A1ABCC4
SCHEMBL7007009 0.82 LMNA (0.47) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL7015378 0.82 CAPN1 (0.45) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL7014330 0.81 DPP4 (0.41) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL7010437 0.81 EPHA2 (0.54) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL10928284 0.81 KDM4E (0.47) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL7008949 0.81 ALDH1A1 (0.55) LMNAKDM4EALDH1A1MEN1KMT2A
SCHEMBL7014014 0.81 DPP4 (0.42) LMNACYP2C9ATP6V1B2TBXA2REDNRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0775702-B1 NOVEL QUINOLONE- OR NAPHTHYRIDONECARBOXYLIC ACID DERIVATIVE OR SALT THEREOF TOYAMA CHEMICAL CO LTD (JP) 2003-07-23 EP disclosed
US-5935952-A ANTIBACTERIAL AGENT TOYAMA CHEMICAL CO., LTD. (JP) 1999-08-10 US disclosed
EP-0775702-A1 NOVEL QUINOLONE- OR NAPHTHYRIDONECARBOXYLIC ACID DERIVATIVE OR SALT THEREOF TOYAMA CHEMICAL CO., LTD. (JP) 1997-05-28 EP disclosed