SCHEMBL31705199

SCHEMBL31705199

O=C(O)c1cc(C2CC2)cc(C2CCN(C(=O)C3COC3)CC2)c1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ NAMPT P43490 8/20 0.41
▸ HTR2B P41595 1/20 0.39
▸ TNKS O95271 1/20 0.37
▸ TNKS2 Q9H2K2 1/20 0.37
▸ KMO O15229 1/20 0.37
▸ ALDH1A1 P00352 2/20 0.37
▸ BACE1 P56817 1/20 0.36
▸ TLR9 Q9NR96 1/20 0.36
▸ TLR8 Q9NR97 1/20 0.36
▸ TLR7 Q9NYK1 1/20 0.36
▸ GPR183 P32249 1/20 0.35
▸ QDPR P09417 1/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ TSHR P16473 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ SCD5 Q86SK9 1/20 0.34
▸ POLB P06746 1/20 0.34

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
SCHEMBL31706109 0.87 NAMPT (0.40) NAMPTHTR2BALDH1A1TLR9TLR8
Lithium Ion SCHEMBL31705499 0.86 NAMPT (0.40) NAMPTHTR2BTNKSTNKS2ALDH1A1
SCHEMBL31704523 0.84 ALDH1A1 (0.42) NAMPTALDH1A1MEN1HPGDKMT2A
SCHEMBL31704958 0.84 ALDH1A1 (0.42) NAMPTALDH1A1MEN1HPGDKMT2A
SCHEMBL31704822 0.80 NAMPT (0.42) NAMPTALDH1A1TSHRSMN1; SMN2
SCHEMBL31705755 0.79 NAMPT (0.39) NAMPTHTR2BTNKSTNKS2ALDH1A1
SCHEMBL31705122 0.77 TLR9 (0.44) NAMPTTLR9TLR8TLR7SCD5
Lithium Ion SCHEMBL31706119 0.77 NAMPT (0.39) NAMPTHTR2BTNKSTNKS2TLR9
Lithium Ion SCHEMBL31705497 0.77 NAMPT (0.39) NAMPTHTR2BTNKSTNKS2TLR9
SCHEMBL4392929 0.76 KMO (0.55) KMOALDH1A1HPGDTSHRSMN1; SMN2

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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