SCHEMBL9757512

SCHEMBL9757512

COC(=O)c1cccc2c1CN(c1c(F)cc3c(=O)c(C(=O)O)cn(-c4ccc(F)cc4)c3c1F)C2

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.47
ALDH1A1 P00352 5/20 0.47
POLB P06746 1/20 0.47
HSP90AA1 P07900 1/20 0.47
RXFP1 Q9HBX9 1/20 0.47
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
LMNA P02545 2/20 0.46
HPGD P15428 4/20 0.46
HSD17B10 Q99714 4/20 0.46
PIM1 P11309 3/20 0.44
ADRA2B P18089 1/20 0.39
MAPK1 P28482 1/20 0.39
TOP1 P11387 3/20 0.38
TOP2A P11388 1/20 0.38
CYP2C19 P33261 1/20 0.37
RORC P51449 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
SCHEMBL9757315 0.90 KDM4E (0.45) KDM4EALDH1A1POLBHSP90AA1RXFP1
SCHEMBL9757261 0.90 LMNA (0.49) KDM4EALDH1A1POLBHSP90AA1RXFP1
SCHEMBL9757293 0.90 LMNA (0.50) KDM4EALDH1A1POLBHSP90AA1RXFP1
SCHEMBL9757148 0.88 LMNA (0.49) KDM4EALDH1A1POLBHSP90AA1RXFP1
SCHEMBL9757372 0.87 PIM1 (0.48) KDM4EALDH1A1POLBHSP90AA1RXFP1
SCHEMBL9757331 0.87 LMNA (0.48) KDM4EALDH1A1POLBHSP90AA1RXFP1
SCHEMBL9757333 0.87 LMNA (0.50) KDM4EALDH1A1POLBHSP90AA1RXFP1
SCHEMBL9757188 0.87 HPGD (0.55) KDM4EALDH1A1POLBHSP90AA1RXFP1
SCHEMBL9757467 0.85 KDM4E (0.48) KDM4EALDH1A1POLBHSP90AA1RXFP1
SCHEMBL9757405 0.84 PIM1 (0.49) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5026856-A Bactericides WAKUNAGA SEIYAKU KABUSHIKI KAISHA (JP) 1991-06-25 US disclosed
EP-0343560-A2 Isoindoline derivative WAKUNAGA SEIYAKU KABUSHIKI KAISHA (JP) 1989-11-29 EP disclosed