SCHEMBL20003572

SCHEMBL20003572

O=S(=O)(c1ccc(Br)cc1Cl)N1CC[C@](O)(CO)C1

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TRPV4 Q9HBA0 14/20 0.50
TRPM8 Q7Z2W7 1/20 0.46
RBP1 P09455 1/20 0.45
MEN1 O00255 1/20 0.43
PKM P14618 1/20 0.43
KMT2A Q03164 1/20 0.43
ABL1 P00519 1/20 0.43
RIN1 Q13671 1/20 0.43
CCR1 P32246 1/20 0.40

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
SCHEMBL23613838 0.88 TRPV4 (0.50) TRPV4TRPM8RBP1
SCHEMBL20003616 0.88 TRPV4 (0.60) TRPV4TRPM8RBP1
SCHEMBL20003518 0.88 TRPV4 (0.60) TRPV4TRPM8RBP1
SCHEMBL23613871 0.88 TRPV4 (0.60) TRPV4TRPM8RBP1
SCHEMBL20003562 0.85 TRPV4 (0.51) TRPV4TRPM8RBP1CCR1
SCHEMBL20003513 0.82 TRPV4 (0.61) TRPV4TRPM8
SCHEMBL20007988 0.82 TRPV4 (0.58) TRPV4MEN1KMT2A
SCHEMBL20003510 0.82 TRPV4 (0.61) TRPV4TRPM8
SCHEMBL20003550 0.82 TRPV4 (0.58) TRPV4MEN1KMT2A
SCHEMBL20007652 0.78 TSHR (0.56) TRPV4RBP1MEN1PKMKMT2A

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-2018055526-A1 TRPV4 ANTAGONISTS GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2018-03-29 WO disclosed