SCHEMBL31184830

SCHEMBL31184830

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

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ HTT P42858 1/20 0.41
▸ TRPV1 Q8NER1 4/20 0.38
▸ TNKS O95271 2/20 0.37
▸ TNKS2 Q9H2K2 2/20 0.37
▸ JAK1 P23458 2/20 0.36
▸ KDM4E B2RXH2 3/20 0.36
▸ KMT2A Q03164 3/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ HPGD P15428 2/20 0.36
▸ HSD17B10 Q99714 2/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ MAPT P10636 1/20 0.36
▸ UBE2M P61081 1/20 0.35
▸ DCUN1D1 Q96GG9 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.34
▸ TSHR P16473 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
SCHEMBL31184910 0.90 TRPV1 (0.40) SMN1; SMN2TRPV1KDM4EKMT2AALDH1A1
SCHEMBL31184789 0.87 ALDH1A1 (0.44) SMN1; SMN2HTTKDM4EKMT2AALDH1A1
SCHEMBL31184646 0.87 SMN1; SMN2 (0.43) SMN1; SMN2HTTTNKSTNKS2JAK1
SCHEMBL31185043 0.86 POLB (0.41) SMN1; SMN2TRPV1KMT2AALDH1A1HPGD
SCHEMBL31184406 0.81 POLB (0.43) SMN1; SMN2TRPV1ALDH1A1HPGDMAPT
SCHEMBL31185102 0.81 POLB (0.44) SMN1; SMN2HTTTRPV1ALDH1A1HPGD
SCHEMBL31184895 0.80 MGLL (0.47) SMN1; SMN2HTTTRPV1KMT2AHPGD
SCHEMBL31184771 0.80 RXFP2 (0.44) TRPV1JAK1KDM4EKMT2AMEN1
SCHEMBL31184995 0.80 MALT1 (0.41) SMN1; SMN2TRPV1KMT2AALDH1A1HPGD
SCHEMBL31184655 0.78 SMN1; SMN2 (0.46) SMN1; SMN2HTTKDM4EKMT2AALDH1A1

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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