SCHEMBL31184686

SCHEMBL31184686

Cc1cccc2c1CN(C1CCC(C(=O)Nc3ccc4cc[nH]c4c3)CC1)C2=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RXFP2 Q8WXD0 1/20 0.45
▸ NOTUM Q6P988 1/20 0.42
▸ NPC1 O15118 2/20 0.41
▸ RAB9A P51151 2/20 0.41
▸ TRPV1 Q8NER1 1/20 0.41
▸ ABL1 P00519 1/20 0.41
▸ ALDH1A1 P00352 2/20 0.40
▸ MAPT P10636 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ TSHR P16473 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ JAK1 P23458 3/20 0.39
▸ MAOA P21397 1/20 0.39
▸ TYK2 P29597 1/20 0.38
▸ EPHX2 P34913 1/20 0.37
▸ GSPT1 P15170 1/20 0.37
▸ CRBN Q96SW2 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
SCHEMBL31184409 0.88 ALDH1A1 (0.40) NPC1RAB9AALDH1A1MAPTSMN1; SMN2
SCHEMBL31184771 0.86 RXFP2 (0.44) RXFP2NOTUMNPC1RAB9ATRPV1
SCHEMBL31184979 0.86 ALDH1A1 (0.46) NPC1RAB9AALDH1A1MAPTSMN1; SMN2
SCHEMBL31184728 0.85 EPHX1 (0.42) NPC1RAB9AALDH1A1MAPTSMN1; SMN2
SCHEMBL31185049 0.84 ALDH1A1 (0.44) NPC1RAB9AALDH1A1MAPTSMN1; SMN2
SCHEMBL31184657 0.84 ALDH1A1 (0.44) NPC1RAB9AALDH1A1MAPTSMN1; SMN2
SCHEMBL31184399 0.83 ALDH1A1 (0.43) NPC1RAB9AALDH1A1MAPTSMN1; SMN2
SCHEMBL31184763 0.83 EPHX2 (0.49) NPC1RAB9AALDH1A1MAPTSMN1; SMN2
SCHEMBL31184994 0.83 GRM1 (0.44) NPC1RAB9AALDH1A1MAPTSMN1; SMN2
SCHEMBL31184428 0.83 KMT2A (0.43) NPC1RAB9AALDH1A1MAPTSMN1; 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-2024220626-A1 SMALL MOLECULE MODULATORS OF OGG1 AZKARRA THERAPEUTICS, INC. (US) 2024-10-24 — — WO disclosed
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