SCHEMBL10484281

SCHEMBL10484281

CCC1CCC(c2ccc(C(=O)Oc3ccccc3)c(F)c2)CC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.39
ALDH1A1 P00352 1/20 0.39
CYP1A2 P05177 2/20 0.38
CYP2C19 P33261 2/20 0.38
HPGD P15428 2/20 0.38
ALOX15 P16050 2/20 0.38
HSD17B10 Q99714 2/20 0.38
RAB9A P51151 2/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
MAPK1 P28482 1/20 0.38
CASP3 P42574 1/20 0.38
SENP8 Q96LD8 1/20 0.38
SENP7 Q9BQF6 1/20 0.38
SENP6 Q9GZR1 1/20 0.38
MAPT P10636 5/20 0.38
HDAC6 Q9UBN7 2/20 0.38
LMNA P02545 1/20 0.38
TP53 P04637 1/20 0.38
CYP3A4 P08684 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
SCHEMBL10484276 1.00 KMT2A (0.39) KMT2AALDH1A1CYP1A2CYP2C19HPGD
SCHEMBL9812523 0.91 HIF1A (0.41) KMT2AALDH1A1HPGDALOX15RAB9A
SCHEMBL9812514 0.91 HIF1A (0.41) KMT2AALDH1A1HPGDALOX15RAB9A
SCHEMBL9812515 0.90 HIF1A (0.39) KMT2ACYP1A2CYP2C19RAB9AMAPT
SCHEMBL9812529 0.90 HIF1A (0.39) KMT2ACYP1A2CYP2C19RAB9AMAPT
SCHEMBL9812404 0.89 CYP11B1 (0.40) RAB9ACASP3SENP8SENP7SENP6
SCHEMBL9812395 0.89 CYP11B1 (0.40) RAB9ACASP3SENP8SENP7SENP6
SCHEMBL9812497 0.88 MAOB (0.38) KMT2ACYP1A2CYP2C19HPGDRAB9A
SCHEMBL9812509 0.88 MAOB (0.38) KMT2ACYP1A2CYP2C19HPGDRAB9A
SCHEMBL9812411 0.88 HIF1A (0.39) KMT2AALDH1A1CYP1A2CYP2C19HPGD

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-4855076-A Fluorophenylcyclohexane derivative CHISSO CORPORATION (JP) 1989-08-08 US disclosed
EP-0219975-A1 Fluorophenylcyclohexane derivative Chisso Corporation (JP) 1987-04-29 EP disclosed