SCHEMBL8446783

SCHEMBL8446783

C=C[C@H]1CC[C@H]([C@H]2CC[C@H](c3cc(F)c(C(F)(F)F)c(F)c3)CC2)CC1

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.30

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
SCHEMBL13002679 1.00 KDM1A (0.30) KDM1A
SCHEMBL8451372 0.95 KDM1A (0.33) KDM1A
SCHEMBL13002301 0.95 KDM1A (0.33) KDM1A
SCHEMBL12975890 0.94
SCHEMBL12975886 0.89 GRM2 (0.33) KDM1A
SCHEMBL8447787 0.88 ESR2 (0.30)
SCHEMBL13002549 0.87 HTR2A (0.30)
SCHEMBL9417919 0.85
SCHEMBL8449032 0.85
SCHEMBL9417923 0.85

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
EP-0647696-B1 Cyclohexane derivative CHISSO CORP (JP) 1999-04-21 EP disclosed
EP-0647696-A1 Cyclohexane derivative Chisso Corporation (JP) 1995-04-12 EP disclosed