SCHEMBL9756422

SCHEMBL9756422

CCCCn1cc(CC(=O)O)c2cc(Cl)c(Cl)cc21

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CDC25A P30304 1/20 0.57
ICMT O60725 11/20 0.47
MCL1 Q07820 3/20 0.47
HDAC6 Q9UBN7 2/20 0.45
HDAC1 Q13547 1/20 0.43
CNR2 P34972 2/20 0.43
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
HSD17B10 Q99714 1/20 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
SCHEMBL15747729 0.78 CDC25A (0.90) CDC25AICMTMCL1CNR2KDM4E
SCHEMBL8577442 0.77 CDC25A (0.59) CDC25AICMTMCL1CNR2KDM4E
SCHEMBL9236079 0.74 CDC25A (0.70) CDC25AICMTCNR2
SCHEMBL2429439 0.74 CDC25A (0.97) CDC25AICMTMCL1CNR2KDM4E
SCHEMBL9700510 0.73 CDC25A (1.00) CDC25AICMTMCL1CNR2KDM4E
SCHEMBL15747697 0.73 CDC25A (1.00) CDC25AICMTMCL1CNR2KDM4E
SCHEMBL11949506 0.69 ICMT (0.83) ICMT
SCHEMBL29195363 0.69 ICMT (0.55) CDC25AICMTCNR2
SCHEMBL30823836 0.69 ICMT (0.55) CDC25AICMTCNR2
SCHEMBL15747715 0.69 CDC25A (0.80) CDC25AICMTMCL1CNR2KDM4E

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-0256128-B1 INDOLEACETIC ACID DERIVATIVES AND USE THEREOF AS PLANT GROWTH REGULATORS NIPPON KAYAKU KABUSHIKI KAISHA (JP) 1991-11-06 EP disclosed
US-4806143-A Indoleacetic acid derivatives and application thereof as plant growth regulators NIPPON KAYAKU KABUSHIKI KAISHA (JP) 1989-02-21 US disclosed
EP-0256128-A1 INDOLEACETIC ACID DERIVATIVES AND USE THEREOF AS PLANT GROWTH REGULATORS NIPPON KAYAKU KABUSHIKI KAISHA (JP) 1988-02-24 EP disclosed