SCHEMBL3823065

SCHEMBL3823065

CN1CCN(Cc2ccc(OC(=O)N[C@H]3N=C(c4ccccc4)c4ccccc4NC3=O)o2)CC1

nearest known ligand 0.54

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CBLB Q13191 17/20 0.54
▸ CCKAR P32238 4/20 0.49
▸ CCKBR P32239 2/20 0.49

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
SCHEMBL3823353 0.93 CBLB (0.55) CBLBCCKARCCKBR
SCHEMBL3828724 0.92 CBLB (0.55) CBLBCCKARCCKBR
SCHEMBL3822275 0.91 CBLB (0.65) CBLBCCKARCCKBR
SCHEMBL3828040 0.84 CCKBR (0.57) CCKARCCKBR
SCHEMBL3827770 0.83 CCKBR (0.53) CCKARCCKBR
SCHEMBL3962382 0.82 CCKBR (0.58) CCKARCCKBR
SCHEMBL3825530 0.79 CCKBR (0.47) CCKARCCKBR
SCHEMBL6064825 0.78 CBLB (0.60) CBLBCCKARCCKBR
SCHEMBL6064671 0.78 CBLB (0.60) CBLBCCKARCCKBR
SCHEMBL3829298 0.77 CBLB (0.64) 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-1727551-B1 PHARMACEUTICAL COMPOSITION COMPRISING A BENZODIAZEPINE DERIVATIVE AND A INHIBITOR OF THE RSV FUSION PROTEIN ARROW THERAPEUTICS LTD (GB) 2009-09-09 — — EP claimed
Send feedback