SCHEMBL24611903

SCHEMBL24611903

CN(Cc1cc(C(F)(F)F)cnc1N1CCOCC1)C1N=C(c2ccccc2)c2ccccc2NC1=O

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CBLB Q13191 14/20 0.41
▸ CCKAR P32238 5/20 0.40
▸ CCKBR P32239 3/20 0.40
▸ OPRM1 P35372 1/20 0.37
▸ OPRL1 P41146 1/20 0.37
▸ MEN1 O00255 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ BACE1 P56817 1/20 0.35

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
SCHEMBL24612393 0.80 CCKAR (0.44) CBLBCCKARCCKBRMEN1ALDH1A1
SCHEMBL24612409 0.80 CCKBR (0.41) CBLBCCKARCCKBRMEN1ALDH1A1
SCHEMBL24612102 0.79 CBLB (0.46) CBLBCCKARCCKBRMEN1ALDH1A1
SCHEMBL24612157 0.78 CCKBR (0.42) CBLBCCKARCCKBRMEN1ALDH1A1
SCHEMBL24612361 0.78 CBLB (0.41) CBLBCCKARCCKBRMEN1ALDH1A1
SCHEMBL24612099 0.77 CBLB (0.41) CBLBCCKARCCKBROPRM1OPRL1
SCHEMBL20474810 0.76 CCKAR (0.44) CBLBCCKARCCKBRALDH1A1
SCHEMBL21755297 0.75 CCKBR (0.45) CBLBCCKARCCKBR
SCHEMBL20098264 0.75 CCKBR (0.45) CBLBCCKARCCKBR
SCHEMBL24612351 0.74 CCKBR (0.43) CCKARCCKBRMEN1ALDH1A1KMT2A

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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