SCHEMBL30152949

SCHEMBL30152949

Cn1cnnc1-c1cc(F)ccc1-c1cccc(-c2nc3ccc(CO)cc3o2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ VSIR Q9H7M9 12/20 0.41
▸ PDCD1 Q15116 7/20 0.41
▸ CD274 Q9NZQ7 7/20 0.41
▸ UTRN P46939 1/20 0.38
▸ NPC1 O15118 2/20 0.36
▸ RAB9A P51151 2/20 0.36
▸ MAPT P10636 2/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ HPN P05981 1/20 0.36
▸ CEPT1 Q9Y6K0 1/20 0.35
▸ HDAC3 O15379 1/20 0.35
▸ HDAC4 P56524 1/20 0.35
▸ HDAC1 Q13547 1/20 0.35
▸ HDAC7 Q8WUI4 1/20 0.35
▸ HDAC2 Q92769 1/20 0.35
▸ HDAC10 Q969S8 1/20 0.35
▸ HDAC11 Q96DB2 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
SCHEMBL24818784 1.00 VSIR (0.41) VSIRPDCD1CD274UTRNNPC1
SCHEMBL24819847 0.93 KDM4E (0.41) VSIRPDCD1CD274UTRNNPC1
SCHEMBL30152980 0.87 VSIR (0.38) VSIRPDCD1CD274UTRNNPC1
SCHEMBL24820770 0.87 VSIR (0.38) VSIRPDCD1CD274UTRNNPC1
SCHEMBL24819912 0.86 TP53 (0.43) NPC1RAB9AMAPTKDM4EALDH1A1
SCHEMBL30153065 0.85 VSIR (0.42) VSIRPDCD1CD274NPC1RAB9A
SCHEMBL24820049 0.85 VSIR (0.42) VSIRPDCD1CD274NPC1RAB9A
SCHEMBL24821901 0.85 VSIR (0.42) VSIRPDCD1CD274NPC1RAB9A
SCHEMBL24818786 0.84 UTRN (0.38) VSIRPDCD1CD274UTRNNPC1
SCHEMBL30153038 0.84 UTRN (0.38) VSIRPDCD1CD274UTRNNPC1

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 3 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
CN-117858865-A CBL-B modulators and uses thereof 林伯士克莱奥公司 2024-04-09 — — CN disclosed
WO-2022272248-A1 CBL-B MODULATORS AND USES THEREOF NIMBUS CLIO, INC. (US) 2022-12-29 — — WO disclosed
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