SCHEMBL30152657

SCHEMBL30152657

Cn1cnnc1-c1cc(F)ccc1-c1cccc(-c2nc3cc(CNC[C@H](O)C(F)(F)F)cc(C(F)(F)F)c3o2)c1

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ VSIR Q9H7M9 13/20 0.40
▸ CBLB Q13191 2/20 0.33
▸ CETP P11597 1/20 0.32
▸ PDCD1 Q15116 4/20 0.31
▸ CD274 Q9NZQ7 4/20 0.31
▸ S1PR1 P21453 3/20 0.31
▸ S1PR3 Q99500 3/20 0.31
▸ HPGD P15428 1/20 0.30

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
SCHEMBL24818686 1.00 VSIR (0.40) VSIRCBLBCETPPDCD1CD274
SCHEMBL30152634 1.00 VSIR (0.40) VSIRCBLBCETPPDCD1CD274
SCHEMBL24819852 0.94 VSIR (0.40) VSIRCBLBCETPPDCD1CD274
SCHEMBL24819907 0.94 VSIR (0.40) VSIRCBLBCETPPDCD1CD274
SCHEMBL24819994 0.93 VSIR (0.42) VSIRCBLBCETPPDCD1CD274
SCHEMBL24820319 0.93 VSIR (0.40) VSIRCBLBCETPPDCD1CD274
SCHEMBL24819727 0.93 VSIR (0.40) VSIRCBLBCETPPDCD1CD274
SCHEMBL24820251 0.92 VSIR (0.40) VSIRCBLBCETPPDCD1CD274
SCHEMBL24818664 0.90 VSIR (0.38) VSIRCBLBCETPPDCD1CD274
SCHEMBL24818667 0.90 VSIR (0.38) VSIRCBLBCETPPDCD1CD274

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4359381-A1 CBL-B MODULATORS AND USES THEREOF Nimbus Clio, Inc. (US) 2024-05-01 — — EP disclosed
WO-2022272248-A1 CBL-B MODULATORS AND USES THEREOF NIMBUS CLIO, INC. (US) 2022-12-29 — — WO disclosed
Send feedback