SCHEMBL4751606

SCHEMBL4751606

N#Cc1ccc(OC(C=O)C2CC2)cc1Cl

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PGR P06401 3/20 0.44
AR P10275 11/20 0.42
MRGPRX4 Q96LA9 1/20 0.39
NR3C1 P04150 1/20 0.39
TRPV4 Q9HBA0 1/20 0.37
BCL2A1 Q16548 1/20 0.36
ESRRA P11474 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
SCHEMBL4748849 0.84 AR (0.43) ARMRGPRX4ESRRA
SCHEMBL177449 0.78 AR (0.53) PGRARMRGPRX4NR3C1TRPV4
SCHEMBL318774 0.76 AR (0.42) PGRARMRGPRX4TRPV4
SCHEMBL4200960 0.75 SLC6A2 (0.49) AR
SCHEMBL473954 0.73 AR (0.49) PGRARMRGPRX4NR3C1TRPV4
SCHEMBL26127201 0.71 AR (0.49) PGRARMRGPRX4NR3C1TRPV4
SCHEMBL10777839 0.71 AR (0.49) PGRARMRGPRX4TRPV4ESRRA
SCHEMBL3177878 0.68 PGR (0.62) PGRARTRPV4
SCHEMBL27376804 0.68 AR (0.52) PGRARMRGPRX4NR3C1TRPV4
SCHEMBL3188688 0.68 PGR (0.62) PGRARTRPV4

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-2008135824-A1 OXYALKYLPYRAZOLE COMPOUNDS USEFUL IN THERAPY PFIZER LIMITED (GB) 2008-11-13 WO disclosed