SCHEMBL24819847

SCHEMBL24819847

Cn1cnnc1-c1cc(F)ccc1-c1cccc(-c2nc3cc(CO)ccc3o2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.41
▸ ALDH1A1 P00352 3/20 0.41
▸ MAPT P10636 3/20 0.41
▸ RAB9A P51151 3/20 0.41
▸ SMN1; SMN2 Q16637 3/20 0.41
▸ NPC1 O15118 2/20 0.41
▸ HPGD P15428 2/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ PDE10A Q9Y233 1/20 0.41
▸ CETP P11597 1/20 0.39
▸ S1PR1 P21453 8/20 0.39
▸ S1PR3 Q99500 7/20 0.39
▸ VSIR Q9H7M9 2/20 0.39
▸ UTRN P46939 1/20 0.38
▸ P2RY14 Q15391 2/20 0.37
▸ NFKB1 P19838 1/20 0.36
▸ NFKB2 Q00653 1/20 0.36
▸ RELA Q04206 1/20 0.36
▸ PDCD1 Q15116 1/20 0.36

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
SCHEMBL30152949 0.93 VSIR (0.41) KDM4EALDH1A1MAPTRAB9ASMN1; SMN2
SCHEMBL24818784 0.93 VSIR (0.41) KDM4EALDH1A1MAPTRAB9ASMN1; SMN2
SCHEMBL30153187 0.89 P2RY14 (0.45) KDM4EALDH1A1MAPTRAB9ASMN1; SMN2
SCHEMBL24819976 0.89 P2RY14 (0.45) KDM4EALDH1A1MAPTRAB9ASMN1; SMN2
SCHEMBL30152980 0.87 VSIR (0.38) KDM4EALDH1A1MAPTRAB9ASMN1; SMN2
SCHEMBL30153065 0.87 VSIR (0.42) MAPTRAB9ANPC1HPGDVSIR
SCHEMBL24820049 0.87 VSIR (0.42) MAPTRAB9ANPC1HPGDCETP
SCHEMBL24820770 0.87 VSIR (0.38) KDM4EALDH1A1MAPTRAB9ASMN1; SMN2
SCHEMBL24821901 0.87 VSIR (0.42) MAPTRAB9ANPC1HPGDVSIR
SCHEMBL24819948 0.87 S1PR1 (0.35) KDM4EALDH1A1MAPTRAB9ASMN1; SMN2

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 4 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
WO-2022272248-A1 CBL-B MODULATORS AND USES THEREOF NIMBUS CLIO, INC. (US) 2022-12-29 — — WO disclosed
Send feedback