SCHEMBL9733320

SCHEMBL9733320

CN(C)C1CCCC(c2cc3c(cc2F)c(=O)c(C(=O)O)cn3-c2ccc(F)cc2)C1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.54
KMT2A Q03164 2/20 0.54
MEN1 O00255 1/20 0.54
KDM4E B2RXH2 4/20 0.51
ALDH1A1 P00352 3/20 0.51
HPGD P15428 1/20 0.51
HSD17B10 Q99714 1/20 0.51
PIM1 P11309 2/20 0.40
GRM2 Q14416 1/20 0.38
POLB P06746 1/20 0.38
HSP90AA1 P07900 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
TP53 P04637 1/20 0.36
CAPN1 P07384 1/20 0.36
TOP1 P11387 1/20 0.35

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
SCHEMBL9731919 0.95 LMNA (0.55) LMNAKMT2AMEN1KDM4EALDH1A1
SCHEMBL9731667 0.87 LMNA (0.53) LMNAKMT2AMEN1KDM4EALDH1A1
SCHEMBL9731522 0.84 LMNA (0.51) LMNAKMT2AMEN1KDM4EALDH1A1
SCHEMBL9732019 0.83 KDM4E (0.52) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL9731768 0.83 LMNA (0.55) LMNAKMT2AMEN1KDM4EALDH1A1
SCHEMBL9731393 0.83 LMNA (0.62) LMNAKMT2AMEN1KDM4EALDH1A1
SCHEMBL9731087 0.82 LMNA (0.69) LMNAKMT2AMEN1KDM4EALDH1A1
SCHEMBL9731957 0.81 LMNA (0.59) LMNAKMT2AMEN1KDM4EALDH1A1
SCHEMBL9733323 0.81 PIM1 (0.51) LMNAKMT2AMEN1KDM4EALDH1A1
SCHEMBL10578012 0.81 LMNA (0.53) LMNAKMT2AMEN1KDM4EALDH1A1

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
US-5081254-A Antibacterial agents WARNER-LAMBERT COMPANY (US) 1992-01-14 US disclosed
US-4929613-A Antibacterial agents WARNER-LAMBERT COMPANY (US) 1990-05-29 US disclosed
EP-0306764-A2 4-Quinolone-3-carboxylic-acid derivatives and their use as antibacterial agents WARNER-LAMBERT COMPANY (US) 1989-03-15 EP disclosed