SCHEMBL31190829

SCHEMBL31190829

FC1CN(Cc2ccccc2)C2(CC2)C1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.39
FUCA1 P04066 2/20 0.38
SIGMAR1 Q99720 1/20 0.37
CYP3A4 P08684 1/20 0.37
HSD17B10 Q99714 1/20 0.37
OPRK1 P41145 1/20 0.36
OPRL1 P41146 1/20 0.35
ALDH1A1 P00352 1/20 0.35
TSHR P16473 1/20 0.35

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
SCHEMBL15866083 0.80 FUCA1 (0.45) HSD11B1FUCA1SIGMAR1OPRK1OPRL1
SCHEMBL31172293 0.80 FUCA1 (0.45) HSD11B1FUCA1SIGMAR1OPRK1OPRL1
SCHEMBL30748878 0.80 GAA (0.39) HSD11B1FUCA1SIGMAR1TSHR
SCHEMBL16080213 0.80 ACHE (0.45) FUCA1SIGMAR1CYP3A4HSD17B10
SCHEMBL19214942 0.75 CTSL (0.47) SIGMAR1OPRL1
SCHEMBL31171606 0.75 MAPT (0.39) FUCA1OPRK1TSHR
SCHEMBL21748529 0.74 ACHE (0.39) SIGMAR1CYP3A4HSD17B10OPRL1ALDH1A1
SCHEMBL21886855 0.72 MEN1 (0.46) FUCA1SIGMAR1TSHR
SCHEMBL1558447 0.71 SIGMAR1 (0.39) SIGMAR1HSD17B10ALDH1A1TSHR
SCHEMBL31172333 0.70 RBP4 (0.40) CYP3A4ALDH1A1

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
WO-2024220747-A2 FLUORINATED CYCLIC DERIVATIVES OF SULFONAMIDES AND SULFONES, AND COMPOSITIONS AND METHODS THEREOF Lysoway Therapeutics, Inc. (US) 2024-10-24 WO disclosed