SCHEMBL6829355

SCHEMBL6829355

Cc1ccc(C(=O)NC2=CC[CH]C(C(C)(C)C)=C2)c(N2CCC(C)CC2)n1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SCN10A Q9Y5Y9 4/20 0.39
KIF18A Q8NI77 10/20 0.38
KMT2A Q03164 2/20 0.35
ALDH1A1 P00352 3/20 0.34
KDM4E B2RXH2 2/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
TRPV1 Q8NER1 1/20 0.34
MEN1 O00255 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
GPR55 Q9Y2T6 1/20 0.33
GPR6 P46095 1/20 0.33

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
SCHEMBL6830890 0.85 KMT2A (0.54) KIF18AKMT2AALDH1A1TRPV1MEN1
SCHEMBL6825968 0.80 SCN10A (0.41) SCN10AKIF18AKMT2AALDH1A1KDM4E
SCHEMBL6825969 0.76 SCN10A (0.52) SCN10AKIF18AKMT2AALDH1A1KDM4E
SCHEMBL6830991 0.72 SCN10A (0.48) SCN10AKIF18AKMT2AALDH1A1KDM4E
SCHEMBL6646172 0.71 KMT2A (0.63) KMT2AALDH1A1KDM4EGAAMAPT
SCHEMBL6826031 0.69 SCN10A (0.47) SCN10AKMT2AALDH1A1KDM4EGAA
SCHEMBL6643128 0.69 ALDH1A1 (0.53) SCN10AKMT2AALDH1A1KDM4EGAA
SCHEMBL6830989 0.68 SCN10A (0.42) SCN10AKIF18AKMT2AALDH1A1KDM4E
SCHEMBL6645120 0.68 ALDH1A1 (0.53) SCN10AKMT2AALDH1A1KDM4EGAA
SCHEMBL6647449 0.66 PDE7A (0.47) SCN10AALDH1A1KDM4EMAPTSMN1; 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-2004039795-A2 AMIDE COMPOUNDS FOR THE TREATMENT OF HYPERLIPIDEMIA FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-05-13 WO disclosed