SCHEMBL31184910

SCHEMBL31184910

CCc1ccc(NC(=O)C2CCC(N3Cc4c(C)cccc4NC3=O)CC2)cc1C

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 4/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ UBE2M P61081 1/20 0.37
▸ DCUN1D1 Q96GG9 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ POLB P06746 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ ALDH1A1 P00352 2/20 0.36
▸ MAPT P10636 2/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ GAA P10253 1/20 0.36
▸ GNRHR P30968 1/20 0.36
▸ SMYD3 Q9H7B4 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
SCHEMBL31185043 0.92 POLB (0.41) TRPV1SMN1; SMN2POLBKMT2ANPSR1
SCHEMBL31184830 0.90 SMN1; SMN2 (0.41) TRPV1SMN1; SMN2UBE2MDCUN1D1KDM4E
SCHEMBL31185102 0.86 POLB (0.44) TRPV1SMN1; SMN2POLBLMNAALDH1A1
SCHEMBL31184660 0.85 SMN1; SMN2 (0.42) SMN1; SMN2UBE2MDCUN1D1KDM4EMEN1
SCHEMBL31184406 0.84 POLB (0.43) TRPV1SMN1; SMN2POLBNPSR1LMNA
SCHEMBL31184771 0.84 RXFP2 (0.44) TRPV1KDM4EMEN1POLBKMT2A
SCHEMBL31184895 0.84 MGLL (0.47) TRPV1SMN1; SMN2MEN1KMT2ALMNA
SCHEMBL31184995 0.83 MALT1 (0.41) TRPV1SMN1; SMN2POLBKMT2AALDH1A1
SCHEMBL31185080 0.82 MALT1 (0.53) SMN1; SMN2ALDH1A1
SCHEMBL31184724 0.82 TP53 (0.43) SMN1; SMN2POLBKMT2ALMNAALDH1A1

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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