SCHEMBL7010392

SCHEMBL7010392

CN1Cc2ccc(-c3nc4c(cc3F)c(=O)c(C(=O)O)cn4CCF)cc2C1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.48
ALDH1A1 P00352 3/20 0.48
LMNA P02545 4/20 0.44
CYP2C9 P11712 1/20 0.44
ATP6V1B2 P21281 1/20 0.44
TBXA2R P21731 1/20 0.44
EDNRA P25101 1/20 0.44
TARBP2 Q15633 1/20 0.44
DRD3 P35462 1/20 0.42
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
ABCC4 O15439 1/20 0.41
PKM P14618 1/20 0.41
PTGS1 P23219 1/20 0.41
HPGD P15428 2/20 0.39
NPC1 O15118 1/20 0.39
TOP1 P11387 6/20 0.38
TSHR P16473 2/20 0.38
HIF1A Q16665 1/20 0.38
TOP2A P11388 1/20 0.36

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
SCHEMBL7006766 0.93 LMNA (0.53) KDM4EALDH1A1LMNACYP2C9ATP6V1B2
SCHEMBL7010109 0.87 LMNA (0.46) KDM4EALDH1A1LMNACYP2C9ATP6V1B2
SCHEMBL7010564 0.84 TOP2A (0.50) KDM4EALDH1A1LMNAABCC4HPGD
SCHEMBL7012905 0.83 LMNA (0.45) KDM4EALDH1A1LMNACYP2C9ATP6V1B2
SCHEMBL7013772 0.83 LMNA (0.52) KDM4EALDH1A1LMNACYP2C9ATP6V1B2
SCHEMBL7014272 0.83 TOP2A (0.41) KDM4EALDH1A1HPGDTOP2ATOP2B
SCHEMBL7008660 0.83 EPHA2 (0.54) KDM4EALDH1A1LMNACYP2C9ATP6V1B2
SCHEMBL7016362 0.81 KDM4E (0.56) KDM4EALDH1A1DRD3MEN1KMT2A
SCHEMBL10928284 0.81 KDM4E (0.47) KDM4EALDH1A1LMNACYP2C9ATP6V1B2
SCHEMBL7010024 0.81 ALDH1A1 (0.60) KDM4EALDH1A1LMNADRD3MEN1

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