SCHEMBL17131111

SCHEMBL17131111

CN1CCc2cc(Cl)cnc2C1=O

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
HPGD P15428 1/20 0.39
HTT P42858 1/20 0.39
HSD17B10 Q99714 1/20 0.39
LMNA P02545 1/20 0.38
PABPC1 P11940 1/20 0.38
GRM5 P41594 4/20 0.35
CYP11B1 P15538 1/20 0.35
CYP11B2 P19099 1/20 0.35
NOTUM Q6P988 1/20 0.34
FNTA P49354 1/20 0.34
FNTB P49356 1/20 0.34
GAA P10253 1/20 0.33
SMN1; SMN2 Q16637 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
SCHEMBL2669108 0.82 HTR1A (0.44) MEN1KMT2AGRM5NOTUMGAA
SCHEMBL799132 0.78 MEN1 (0.38) MEN1KMT2AGRM5CYP11B1CYP11B2
SCHEMBL21603224 0.74 GRM5 (0.45) MEN1KMT2AHPGDHTTHSD17B10
SCHEMBL568921 0.72 PTGS1 (0.39) MEN1KMT2AHPGDHTTHSD17B10
SCHEMBL10314871 0.70 GRM5 (0.53) GRM5CYP11B2
SCHEMBL19699124 0.70 HTR1A (0.47) GRM5
SCHEMBL31743068 0.70 GRM5 (0.56) MEN1KMT2AHTTGRM5CYP11B1
SCHEMBL10271348 0.69 MAOA (0.37) MEN1KMT2AHPGDHTTHSD17B10
SCHEMBL25256410 0.69 MEN1 (0.41) MEN1KMT2AHPGDHTTLMNA
SCHEMBL31587247 0.69 HTR1A (0.43) MEN1KMT2AGRM5NOTUM

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-2015146928-A1 HETEROCYCLIC COMPOUND 武田薬品工業株式会社 2015-10-01 WO disclosed