SCHEMBL25330458

SCHEMBL25330458

C=Cc1c(F)ccc(C#N)c1C(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
AR P10275 18/20 0.41
TRPV4 Q9HBA0 1/20 0.35
CYP11B1 P15538 1/20 0.35
CYP11B2 P19099 1/20 0.35
PGR P06401 6/20 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
SCHEMBL31131379 1.00 AR (0.41) ARTRPV4CYP11B1CYP11B2PGR
SCHEMBL3335216 0.82 AR (0.41) ARTRPV4CYP11B1CYP11B2PGR
SCHEMBL31131413 0.77 AR (0.45) ARTRPV4CYP11B1CYP11B2PGR
SCHEMBL25330095 0.77 AR (0.45) ARTRPV4CYP11B1CYP11B2PGR
SCHEMBL221885 0.74 AR (0.58) ARPGR
SCHEMBL15421833 0.74 AR (0.42) ARTRPV4CYP11B1CYP11B2PGR
SCHEMBL31131407 0.74 AR (0.43) ARPGR
SCHEMBL25329498 0.74 AR (0.43) ARPGR
SCHEMBL16960193 0.71 AR (0.37) AR
SCHEMBL29378798 0.69 AR (0.41) ARTRPV4PGR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4466260-A1 COMPOUNDS AND THEIR USE IN TREATING CANCER Astrazeneca AB (SE) 2024-11-27 EP disclosed
WO-2023139199-A1 COMPOUNDS AND THEIR USE IN TREATING CANCER ASTRAZENECA AB (SE) 2023-07-27 WO disclosed
WO-2023139199-A1 COMPOUNDS AND THEIR USE IN TREATING CANCER ASTRAZENECA AB (SE) 2023-07-27 WO disclosed