SCHEMBL24670529

SCHEMBL24670529

COC(=O)c1cc(C2=CCN(C(=O)OC(C)(C)C)CC2)cs1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ NAMPT P43490 1/20 0.50
▸ PDK4 Q16654 1/20 0.46
▸ GRM1 Q13255 9/20 0.45
▸ GRM5 P41594 8/20 0.45
▸ GPR119 Q8TDV5 2/20 0.44
▸ CYP11B2 P19099 1/20 0.44
▸ CDK7 P50613 1/20 0.43
▸ CDK13 Q14004 1/20 0.43
▸ CDK12 Q9NYV4 1/20 0.43
▸ JAK1 P23458 1/20 0.42
▸ BTK Q06187 1/20 0.42
▸ WNT3A P56704 1/20 0.41
▸ SOS1 Q07889 1/20 0.41
▸ LIPC P11150 1/20 0.41
▸ LIPG Q9Y5X9 1/20 0.41

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
SCHEMBL31283961 0.89 NAMPT (0.40) NAMPTPDK4GRM1GRM5GPR119
SCHEMBL24669223 0.84 NAMPT (0.61) NAMPTPDK4GRM1GRM5GPR119
SCHEMBL16423305 0.84 NAMPT (0.51) NAMPTPDK4GRM1GRM5GPR119
SCHEMBL2951348 0.80 NAMPT (0.60) NAMPTPDK4GRM1GRM5CYP11B2
SCHEMBL24670469 0.80 NAMPT (0.49) NAMPTPDK4GRM1GRM5GPR119
SCHEMBL24671087 0.80 PDK4 (0.50) NAMPTPDK4GRM1GRM5GPR119
SCHEMBL31704953 0.79 NAMPT (0.52) NAMPTPDK4GRM1GRM5CYP11B2
SCHEMBL30736760 0.79 NAMPT (0.52) NAMPTPDK4GRM1GRM5CYP11B2
SCHEMBL24718282 0.79 NAMPT (0.56) NAMPTPDK4GRM1GRM5CYP11B2
SCHEMBL30798377 0.79 NAMPT (0.56) NAMPTPDK4GRM1GRM5CYP11B2

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
WO-2025215110-A1 NEW AMIDE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USES AS SOS1 INHIBITORS LES LABORATOIRES SERVIER (FR) 2025-10-16 — — WO disclosed
WO-2022192162-A1 NOVEL HETEROAROMATIC COMPOUNDS EXHIBITING ANTIFUNGAL ACTIVITY AND THEIR METHOD OF USE FOX CHASE CHEMICAL DIVERSITY CENTER, INC. (US) 2022-09-15 — — WO disclosed
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