SCHEMBL9537286

SCHEMBL9537286

NC1CCC2=C1CN(c1c(F)cc3c(=O)c(C(=O)O)cn(-c4ccc(F)cc4)c3c1F)C2

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.46
ALDH1A1 P00352 3/20 0.46
POLB P06746 1/20 0.46
HSP90AA1 P07900 1/20 0.46
RXFP1 Q9HBX9 1/20 0.46
PIM1 P11309 2/20 0.46
LMNA P02545 3/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
HPGD P15428 2/20 0.45
HSD17B10 Q99714 2/20 0.45
TOP1 P11387 3/20 0.42
TOP2A P11388 8/20 0.41
TOP2B Q02880 6/20 0.41

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
SCHEMBL9535373 0.90 KMT2A (0.49) KDM4EALDH1A1POLBHSP90AA1RXFP1
SCHEMBL9539535 0.88 KDM4E (0.45) KDM4EALDH1A1POLBHSP90AA1RXFP1
SCHEMBL9241429 0.84 ALDH1A1 (0.54) KDM4EALDH1A1POLBLMNAMEN1
SCHEMBL9537199 0.83 LMNA (0.61) KDM4EALDH1A1POLBHSP90AA1RXFP1
SCHEMBL9536182 0.83 KDM4E (0.43) KDM4EALDH1A1POLBPIM1LMNA
SCHEMBL9534341 0.83 KDM4E (0.58) KDM4EALDH1A1POLBLMNAMEN1
SCHEMBL9693352 0.83 KDM4E (0.52) KDM4EALDH1A1POLBHSP90AA1RXFP1
SCHEMBL9757311 0.82 LMNA (0.53) KDM4EALDH1A1POLBHSP90AA1RXFP1
SCHEMBL9869412 0.81 TOP2A (0.61) ALDH1A1POLBKMT2ATOP1TOP2A
SCHEMBL9757188 0.81 HPGD (0.55) KDM4EALDH1A1POLBHSP90AA1RXFP1

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
WO-1993013090-A1 NOVEL QUINOLONE CARBOXYLIC ACID DERIVATIVES AND PROCESSES FOR PREPARING SAME HOECHST AKTIENGESELLSCHAFT (DE) 1993-07-08 WO disclosed
EP-0549857-A1 Antibacterial quinolone carboxylic acid derivatives KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1993-07-07 EP disclosed
EP-0550019-A2 Novel quinolone carboxylic acid derivatives and processes for preparing same KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1993-07-07 EP disclosed