SCHEMBL8563384

SCHEMBL8563384

CCCC1(c2ccccc2F)CCC(C(=O)O)CC1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 2/20 0.40
NOTUM Q6P988 1/20 0.38
HDAC4 P56524 9/20 0.38
OPRL1 P41146 4/20 0.36
PDK2 Q15119 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.34
HCAR2 Q8TDS4 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
SCHEMBL8562488 0.92 HSD11B1 (0.39) HSD11B1NOTUMHDAC4OPRL1PDK2
SCHEMBL7511121 0.91 HSD11B1 (0.39) HSD11B1NOTUMHDAC4OPRL1PDK2
SCHEMBL7507861 0.90 S1PR1 (0.38) HSD11B1NOTUMHDAC4OPRL1
SCHEMBL8559067 0.89 NOTUM (0.40) HSD11B1NOTUMHDAC4OPRL1PDK2
SCHEMBL8045475 0.81 GLA (0.41) L3MBTL1
SCHEMBL7507058 0.79 PDE4B (0.41) L3MBTL1
SCHEMBL15043623 0.78 ESR1 (0.44) HDAC4
SCHEMBL7513588 0.77 CASP1 (0.41) HDAC4OPRL1L3MBTL1
SCHEMBL8725831 0.77 CYSLTR2 (0.43)
SCHEMBL10787675 0.77 HDAC4 (0.40) NOTUMHDAC4OPRL1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5714088-A TRIFLUOROMETHYL- OR -METHOXYPHENYL-SUBSTITUTED BRANCHED ALKYL-SUBSTITUTED CYCLOHEXANES; LARGE POSITIVE VALUE OF DIELECTRIC ANISOTROPY; VERY LOW VISCOSITY; HIGH VOLTAGE HOLDING RATIO(SPECIFIC RESISTANCE); UV STABILITY CHISSO CORPORATION (JP) 1998-02-03 US disclosed