SCHEMBL24612121

SCHEMBL24612121

N=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)OC(=N)c1nc(C(F)F)sc1N1CCOCC1

nearest known ligand 0.49

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CBLB Q13191 12/20 0.49
▸ CCKAR P32238 7/20 0.43
▸ CCKBR P32239 6/20 0.43

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
SCHEMBL20867156 1.00 CBLB (0.49) CBLBCCKARCCKBR
SCHEMBL20866787 0.90 CBLB (0.51) CBLBCCKARCCKBR
SCHEMBL20867293 0.90 CBLB (0.51) CBLBCCKARCCKBR
SCHEMBL20867195 0.90 CBLB (0.51) CBLBCCKARCCKBR
SCHEMBL24611965 0.90 CBLB (0.51) CBLBCCKARCCKBR
SCHEMBL20867091 0.89 CBLB (0.49) CBLBCCKARCCKBR
SCHEMBL24612020 0.88 CBLB (0.49) CBLBCCKARCCKBR
SCHEMBL24612260 0.88 CBLB (0.49) CBLBCCKARCCKBR
SCHEMBL20867105 0.88 CBLB (0.49) CBLBCCKARCCKBR
SCHEMBL20867392 0.88 CBLB (0.49) CBLBCCKARCCKBR

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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