SCHEMBL31705087

SCHEMBL31705087

COC(=O)c1cncc(N2CCN(C(=O)C3CC3)CC2)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 1/20 0.48
▸ MAPT P10636 6/20 0.46
▸ KMT2A Q03164 3/20 0.46
▸ MEN1 O00255 2/20 0.46
▸ ALDH1A1 P00352 2/20 0.46
▸ ATM Q13315 1/20 0.46
▸ GAA P10253 1/20 0.45
▸ CYP11B1 P15538 1/20 0.45
▸ CYP11B2 P19099 1/20 0.45
▸ TP53 P04637 3/20 0.42
▸ MTNR1B P49286 2/20 0.42
▸ CYP1A2 P05177 1/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ HPGD P15428 1/20 0.42
▸ LMNA P02545 1/20 0.42
▸ CHRNB2 P17787 1/20 0.41
▸ CHRNA4 P43681 1/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ NAMPT P43490 1/20 0.40

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
SCHEMBL31705168 0.89 ATM (0.43) TDP1MAPTKMT2AMEN1ALDH1A1
SCHEMBL31706677 0.84 TDP1 (0.52) TDP1MAPTKMT2AMEN1ALDH1A1
Lithium Ion SCHEMBL31706878 0.82 TDP1 (0.50) TDP1MAPTKMT2AMEN1ALDH1A1
Lithium Ion SCHEMBL31704582 0.82 TDP1 (0.50) TDP1MAPTKMT2AMEN1ALDH1A1
SCHEMBL3939071 0.81 ATM (0.53) MAPTKMT2AMEN1ALDH1A1ATM
Hydrochloric Acid SCHEMBL3327647 0.81 ATM (0.47) MAPTKMT2AALDH1A1ATMCYP11B1
SCHEMBL23572659 0.80 GPR119 (0.48) MAPTKMT2AMEN1ALDH1A1ATM
SCHEMBL31706262 0.80 ATM (0.46) KMT2AMEN1ALDH1A1ATMGAA
SCHEMBL20604746 0.79 CHRNB2 (0.61) ALDH1A1ATMCYP11B1CYP11B2CHRNB2
SCHEMBL664858 0.79 ATM (0.50) MAPTKMT2AMEN1ALDH1A1ATM

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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