SCHEMBL31705168

SCHEMBL31705168

COC(=O)c1cncc(N2CCN(C(=O)C3COC3)CC2)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 1/20 0.43
▸ ALDH1A1 P00352 4/20 0.40
▸ CYP11B1 P15538 1/20 0.40
▸ CYP11B2 P19099 1/20 0.40
▸ CHRNB2 P17787 1/20 0.39
▸ CHRNA4 P43681 1/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ NAMPT P43490 1/20 0.39
▸ MAPT P10636 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ CHRNB4 P30926 1/20 0.38
▸ CHRNA3 P32297 1/20 0.38
▸ ATR Q13535 1/20 0.37
▸ TP53 P04637 1/20 0.37
▸ MTOR P42345 1/20 0.37

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
SCHEMBL31705087 0.89 TDP1 (0.48) ATMALDH1A1CYP11B1CYP11B2CHRNB2
Lithium Ion SCHEMBL31706365 0.83 CHRNB2 (0.41) ALDH1A1CHRNB2CHRNA4KMT2ANAMPT
SCHEMBL31705614 0.81 ATM (0.41) ATMALDH1A1CYP11B1CYP11B2KMT2A
SCHEMBL664858 0.81 ATM (0.50) ATMALDH1A1CYP11B1CYP11B2KMT2A
SCHEMBL31706230 0.80 ATM (0.42) ATMALDH1A1CYP11B1CYP11B2NAMPT
SCHEMBL31704511 0.78 ALDH1A1 (0.40) ALDH1A1KMT2ANPC1RAB9AMAPT
SCHEMBL31706224 0.78 ALDH1A1 (0.40) ALDH1A1KMT2ANPC1RAB9AMAPT
SCHEMBL3939071 0.78 ATM (0.53) ATMALDH1A1CYP11B1CYP11B2CHRNB2
SCHEMBL23572659 0.77 GPR119 (0.48) ATMALDH1A1KMT2ANAMPTMAPT
SCHEMBL31705602 0.77 NAMPT (0.48) ALDH1A1CHRNB2CHRNA4KMT2ANAMPT

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
Send feedback