SCHEMBL30152666

SCHEMBL30152666

Cn1cnnc1-c1cc(F)ccc1-c1cccc(-c2nc3cc(NCCN4CCC4)cc(C(F)(F)F)c3o2)c1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ VSIR Q9H7M9 4/20 0.34
▸ CHRNA7 P36544 1/20 0.34
▸ KCNH2 Q12809 1/20 0.34
▸ S1PR1 P21453 7/20 0.33
▸ S1PR3 Q99500 6/20 0.33
▸ LCK P06239 2/20 0.32
▸ KDR P35968 2/20 0.32
▸ MAPK14 Q16539 2/20 0.32
▸ CETP P11597 1/20 0.32
▸ GRIN1 Q05586 1/20 0.32
▸ GRIN2B Q13224 1/20 0.32
▸ PDCD1 Q15116 2/20 0.32
▸ CD274 Q9NZQ7 2/20 0.32
▸ USP2 O75604 1/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ CYP2D6 P10635 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ CLK4 Q9HAZ1 1/20 0.32

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
SCHEMBL24820425 1.00 VSIR (0.34) VSIRCHRNA7KCNH2S1PR1S1PR3
SCHEMBL24818822 0.91 VSIR (0.34) VSIRCETPCBLBHPGD
SCHEMBL30152901 0.91 VSIR (0.34) VSIRCETPCBLBHPGD
SCHEMBL30152896 0.89 VSIR (0.34) VSIRS1PR1S1PR3CETPCBLB
SCHEMBL24820329 0.89 VSIR (0.34) VSIRS1PR1S1PR3CETPCBLB
SCHEMBL30152636 0.89 VSIR (0.34) VSIRS1PR1S1PR3CETPCBLB
SCHEMBL24818797 0.89 VSIR (0.34) VSIRS1PR1S1PR3CETPCBLB
SCHEMBL24818674 0.83 VSIR (0.40) VSIRS1PR1S1PR3CETPCBLB
SCHEMBL29189950 0.83 CHRNA7 (0.39) CHRNA7KCNH2S1PR1S1PR3USP2
SCHEMBL24821954 0.82 CBLB (0.33) VSIRKCNH2S1PR1CETPCBLB

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