SCHEMBL24612334

SCHEMBL24612334

N=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)OC(=N)c1ncc(C(F)F)cc1N1CCOCC1

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ CBLB Q13191 10/20 0.48
▸ CCKAR P32238 6/20 0.42
▸ CCKBR P32239 6/20 0.42
▸ NOTCH1 P46531 1/20 0.41
▸ NOTCH3 Q9UM47 1/20 0.41

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
SCHEMBL24612111 0.91 CBLB (0.49) CBLBCCKARCCKBR
SCHEMBL20866624 0.91 CBLB (0.49) CBLBCCKARCCKBR
SCHEMBL20867095 0.91 CBLB (0.49) CBLBCCKARCCKBR
SCHEMBL20867088 0.90 CCKAR (0.50) CBLBCCKARCCKBR
SCHEMBL20867031 0.90 CCKAR (0.50) CBLBCCKARCCKBR
SCHEMBL24611906 0.89 CBLB (0.49) CBLBCCKARCCKBR
SCHEMBL20866796 0.89 CBLB (0.48) CBLBCCKARCCKBR
SCHEMBL20867108 0.89 CBLB (0.48) CBLBCCKARCCKBR
SCHEMBL20867157 0.89 CBLB (0.49) CBLBCCKARCCKBR
SCHEMBL24612367 0.88 CBLB (0.48) 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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