SCHEMBL24612050

SCHEMBL24612050

CC1(c2nc(C(=N)OC(=N)NC3N=C(c4ccccc4)c4ccccc4NC3=O)c(N)s2)CCC1

nearest known ligand 0.46

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CCKBR P32239 17/20 0.46
▸ CCKAR P32238 12/20 0.46

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
SCHEMBL24612098 0.98 CCKBR (0.47) CCKBRCCKAR
SCHEMBL20867170 0.86 CCKBR (0.44) CCKBRCCKAR
SCHEMBL20867068 0.86 CCKBR (0.44) CCKBRCCKAR
SCHEMBL24611952 0.85 CBLB (0.48) CCKBRCCKAR
SCHEMBL20867067 0.84 CBLB (0.42) CCKBRCCKAR
SCHEMBL24612372 0.84 CCKBR (0.44) CCKBRCCKAR
SCHEMBL24612034 0.83 CCKBR (0.52) CCKBRCCKAR
SCHEMBL24612445 0.83 CBLB (0.48) CCKBRCCKAR
SCHEMBL20867065 0.83 CBLB (0.49) CCKBRCCKAR
SCHEMBL24612353 0.82 CBLB (0.46) CCKBRCCKAR

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
EP-3324977-B1 BENZODIAZEPINE DERIVATIVES AS RSV INHIBITORS ENANTA PHARM INC (US) 2022-07-13 — — EP disclosed
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