SCHEMBL9812411

SCHEMBL9812411

CC[C@H]1CC[C@H](c2ccc(C(=O)Oc3ccc(-c4ccc(F)cc4)cc3)c(F)c2)CC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 1/20 0.39
RARA P10276 1/20 0.37
RARB P10826 1/20 0.37
MAPT P10636 3/20 0.36
THRB P10828 1/20 0.36
SLC6A4 P31645 1/20 0.36
SLC6A3 Q01959 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C19 P33261 1/20 0.36
MAOB P27338 1/20 0.36
NAAA Q02083 1/20 0.35
FFAR4 Q5NUL3 1/20 0.35
DGAT1 O75907 1/20 0.35
ALDH1A1 P00352 1/20 0.34
KMT2A Q03164 1/20 0.34
PARP10 Q53GL7 2/20 0.34
PARP15 Q460N3 1/20 0.34
CRBN Q96SW2 1/20 0.34
KDM4E B2RXH2 1/20 0.34
LMNA P02545 1/20 0.34

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
SCHEMBL9812415 1.00 HIF1A (0.39) HIF1ARARARARBMAPTTHRB
SCHEMBL9812514 0.97 HIF1A (0.41) HIF1AMAOBALDH1A1KMT2APARP10
SCHEMBL9812523 0.97 HIF1A (0.41) HIF1AMAOBALDH1A1KMT2APARP10
SCHEMBL9812709 0.90 TP53 (0.41) RARARARBMAPTTHRBALDH1A1
SCHEMBL9812702 0.90 TP53 (0.41) RARARARBMAPTTHRBALDH1A1
SCHEMBL9812404 0.88 CYP11B1 (0.40) MAPTMAOBNPC1RAB9A
SCHEMBL9812395 0.88 CYP11B1 (0.40) MAPTMAOBNPC1RAB9A
SCHEMBL10484276 0.88 KMT2A (0.39) HIF1AMAPTSLC6A3CYP1A2CYP2C19
SCHEMBL10484281 0.88 KMT2A (0.39) HIF1AMAPTSLC6A3CYP1A2CYP2C19
SCHEMBL10484284 0.87 CYP2C9 (0.47) HIF1AMAPTALDH1A1KMT2APARP10

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-0219975-B1 FLUOROPHENYLCYCLOHEXANE DERIVATIVE Chisso Corporation (JP) 1991-07-03 EP disclosed
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