SCHEMBL31706212

SCHEMBL31706212

C[Si]1(C)CCN(c2cncc(C(=O)O)c2)CC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CHEK1 O14757 3/20 0.46
▸ HCAR2 Q8TDS4 4/20 0.45
▸ CHRNB2 P17787 2/20 0.44
▸ CHRNA4 P43681 2/20 0.44
▸ KDM4E B2RXH2 4/20 0.41
▸ ALDH1A1 P00352 4/20 0.41
▸ MEN1 O00255 3/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ POLB P06746 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ DDO Q99489 1/20 0.41
▸ GAA P10253 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ CYP2C9 P11712 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ MKNK1 Q9BUB5 1/20 0.38
▸ MKNK2 Q9HBH9 1/20 0.38
▸ KMO O15229 1/20 0.37
▸ CHRNB4 P30926 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
SCHEMBL29420013 0.85 CHRNB2 (0.51) CHEK1HCAR2CHRNB2CHRNA4KDM4E
SCHEMBL20187819 0.85 CHRNB2 (0.51) CHEK1HCAR2CHRNB2CHRNA4KDM4E
Lithium Ion SCHEMBL31705050 0.85 CHRNB2 (0.42) CHEK1CHRNB2CHRNA4ALDH1A1LMNA
Lithium Ion SCHEMBL31706241 0.85 CHRNB2 (0.42) CHEK1CHRNB2CHRNA4ALDH1A1LMNA
SCHEMBL31705857 0.84 ATM (0.49) CHRNB2CHRNA4ALDH1A1KMT2ACHRNB4
SCHEMBL31706868 0.84 ATM (0.49) CHRNB2CHRNA4ALDH1A1KMT2ACHRNB4
SCHEMBL5593185 0.82 ALDH1A1 (0.57) CHEK1HCAR2CHRNB2CHRNA4KDM4E
SCHEMBL23610380 0.81 CHRNB2 (0.55) CHEK1HCAR2CHRNB2CHRNA4KDM4E
SCHEMBL29420017 0.81 CHRNB2 (0.55) CHEK1HCAR2CHRNB2CHRNA4KDM4E
SCHEMBL3941724 0.81 KDM4E (0.56) CHEK1HCAR2CHRNB2CHRNA4KDM4E

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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