SCHEMBL31705707

SCHEMBL31705707

CC1(N2CCN(c3ccnc(C(=O)O)n3)CC2)CC1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ SORD Q00796 9/20 0.42
▸ HRH4 Q9H3N8 6/20 0.40
▸ HRH3 Q9Y5N1 5/20 0.40
▸ PTGER4 P35408 1/20 0.38
▸ KMO O15229 2/20 0.38
▸ GBA1 P04062 1/20 0.36
▸ PIK3CA P42336 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
SCHEMBL31706327 0.92 ROCK2 (0.39) SORDHRH4HRH3PTGER4KMO
SCHEMBL31706076 0.85 ROCK2 (0.41) SORDHRH4HRH3
SCHEMBL21880062 0.81 KMO (0.53) SORDHRH4HRH3KMOGBA1
SCHEMBL27457780 0.80 PTGER4 (0.45) SORDHRH4HRH3PTGER4KMO
SCHEMBL31705670 0.77 MAP4K4 (0.52) SORDGBA1
SCHEMBL31704996 0.77 CKS1B (0.55) SORDHRH4HRH3GBA1
SCHEMBL31706098 0.74 CKS1B (0.55) SORDGBA1
SCHEMBL31705458 0.71 CKS1B (0.44) SORDKMOGBA1PIK3CA
SCHEMBL509692 0.71 SORD (0.59) SORDHRH4HRH3
SCHEMBL509736 0.69 SORD (0.61) SORDHRH4HRH3KMOGBA1

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 1 patent. 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
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