SCHEMBL7012437

SCHEMBL7012437

CN1Cc2ccc(-c3cc4c(cc3F)c(=O)c(C(=O)O)cn4[C@@H]3C[C@@H]3F)cc2C1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.40
ALDH1A1 P00352 7/20 0.40
LMNA P02545 3/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
TOP2A P11388 4/20 0.39
TOP2B Q02880 4/20 0.39
DRD3 P35462 1/20 0.39
HPGD P15428 5/20 0.39
HSD17B10 Q99714 4/20 0.39
MAPT P10636 1/20 0.39
CYP1A2 P05177 2/20 0.39
CYP2C9 P11712 1/20 0.39
ALB P02768 1/20 0.38
HRH3 Q9Y5N1 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
TUBB4A P04350 1/20 0.38
POLB P06746 1/20 0.38
TUBB P07437 1/20 0.38
TUBA3C P0DPH7 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
SCHEMBL8327077 1.00 KDM4E (0.40) KDM4EALDH1A1LMNAMEN1KMT2A
SCHEMBL7007516 0.89 KDM4E (0.52) KDM4EALDH1A1LMNATOP2ATOP2B
SCHEMBL7013592 0.86 KDM4E (0.43) KDM4EALDH1A1LMNATOP2ATOP2B
SCHEMBL8323622 0.86 KDM4E (0.43) KDM4EALDH1A1LMNATOP2ATOP2B
SCHEMBL8319164 0.83 TOP2A (0.56) KDM4EALDH1A1KMT2ATOP2ATOP2B
SCHEMBL7009753 0.83 TOP2A (0.56) KDM4EALDH1A1KMT2ATOP2ATOP2B
SCHEMBL7010024 0.82 ALDH1A1 (0.60) KDM4EALDH1A1LMNAMEN1KMT2A
SCHEMBL7007921 0.82 DRD3 (0.60) KDM4EALDH1A1LMNAMEN1KMT2A
SCHEMBL7014272 0.82 TOP2A (0.41) KDM4EALDH1A1TOP2ATOP2BHPGD
SCHEMBL8319527 0.82 TOP2A (0.46) KDM4EALDH1A1KMT2ATOP2ATOP2B

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