SCHEMBL7004940

SCHEMBL7004940

CN1Cc2ccc(-c3c(F)cc4c(=O)c(C(=O)O)cn(-c5ccc(F)cc5)c4c3Cl)cc2C1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.51
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
PIM1 P11309 3/20 0.45
KDM4E B2RXH2 5/20 0.42
ALDH1A1 P00352 2/20 0.42
HPGD P15428 2/20 0.42
HSD17B10 Q99714 2/20 0.42
POLB P06746 1/20 0.41
HSP90AA1 P07900 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
TOP2A P11388 6/20 0.40
TOP2B Q02880 5/20 0.40
TOP1 P11387 1/20 0.38
CYP3A4 P08684 2/20 0.37
CYP2C9 P11712 2/20 0.37
ADRA2B P18089 1/20 0.37
MAPK1 P28482 1/20 0.37
KCNH2 Q12809 1/20 0.37

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
SCHEMBL7008849 0.94 TOP2A (0.48) LMNAMEN1KMT2APIM1KDM4E
SCHEMBL7011261 0.91 LMNA (0.52) LMNAMEN1KMT2APIM1KDM4E
SCHEMBL7004318 0.90 LMNA (0.52) LMNAMEN1KMT2APIM1KDM4E
SCHEMBL7009299 0.90 LMNA (0.45) LMNAMEN1KMT2AKDM4EALDH1A1
SCHEMBL7010005 0.88 LMNA (0.49) LMNAMEN1KMT2APIM1KDM4E
SCHEMBL7011692 0.86 LMNA (0.47) LMNAMEN1KMT2APIM1KDM4E
SCHEMBL7014275 0.85 LMNA (0.49) LMNAMEN1KMT2APIM1KDM4E
SCHEMBL7008277 0.85 LMNA (0.47) LMNAMEN1KMT2APIM1KDM4E
SCHEMBL7010887 0.85 TOP2A (0.56) LMNAMEN1KMT2APIM1KDM4E
SCHEMBL7009203 0.84 TOP2A (0.48) LMNAMEN1KMT2APIM1KDM4E

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