SCHEMBL31076303

SCHEMBL31076303

COC[C@H](C)c1cc(F)c(OC)c(Br)c1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.35
CA4 P22748 2/20 0.35
ADRB2 P07550 3/20 0.33
CA1 P00915 1/20 0.31
CA6 P23280 1/20 0.31
ALOX5AP P20292 1/20 0.30
FEN1 P39748 1/20 0.30

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
SCHEMBL31075765 1.00 CA2 (0.35) CA2CA4ADRB2CA1CA6
SCHEMBL31076037 0.84 ADRB2 (0.41) CA2CA4ADRB2CA1CA6
SCHEMBL31075666 0.84 ADRB2 (0.41) CA2CA4ADRB2CA1CA6
SCHEMBL31075853 0.84 ADRB2 (0.41) CA2CA4ADRB2CA1CA6
SCHEMBL9957836 0.81 CA2 (0.41) CA2CA4ADRB2CA1CA6
SCHEMBL31063174 0.81 CA2 (0.41) CA2CA4ADRB2CA1CA6
SCHEMBL31076231 0.78
SCHEMBL31075874 0.78
SCHEMBL31063457 0.78 CA2 (0.38) CA2CA4ADRB2CA1CA6
SCHEMBL31063360 0.78 CA2 (0.38) CA2CA4ADRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4665458-A1 INHIBITING ALPHA V BETA8 INTEGRIN Morphic Therapeutic, Inc. (US) 2025-12-24 EP disclosed
WO-2024173572-A1 INHIBITING α vβ8 INTEGRIN MORPHIC THERAPEUTIC, INC. (US) 2024-08-22 WO disclosed