SCHEMBL7201171

SCHEMBL7201171

Cc1ccc(C(=O)Nc2cnn(CCN(C(=O)O)c3ccccc3)c2)c(N(C)C)c1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SCD O00767 2/20 0.43
SCD5 Q86SK9 2/20 0.43
HCRTR2 O43614 8/20 0.41
HCRTR1 O43613 3/20 0.41
ALDH1A1 P00352 2/20 0.41
MAPT P10636 1/20 0.41
RAB9A P51151 1/20 0.41
KMT2A Q03164 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
MAPK8 P45983 1/20 0.39
MAPK9 P45984 1/20 0.39
MAPK10 P53779 1/20 0.39
RPS6KA2 Q15349 1/20 0.39
GRM4 Q14833 1/20 0.38
TAS2R8 Q9NYW2 4/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL6642965 0.89 SCD (0.41) SCDSCD5HCRTR2HCRTR1ALDH1A1
SCHEMBL6645504 0.88 TRPV4 (0.42) SCDSCD5ALDH1A1MAPTRAB9A
SCHEMBL7201167 0.83 THRB (0.40) ALDH1A1MAPTRAB9AKMT2ATDP1
SCHEMBL6648250 0.83 L3MBTL1 (0.43) HCRTR2HCRTR1ALDH1A1MAPTRAB9A
SCHEMBL6644189 0.80 AURKA (0.41) SCDSCD5HCRTR2HCRTR1ALDH1A1
SCHEMBL6644600 0.80 SCD (0.42) SCDSCD5ALDH1A1MAPTRAB9A
SCHEMBL6650001 0.78 TRPV4 (0.45) SCDSCD5
SCHEMBL6647477 0.75 MEN1 (0.38) ALDH1A1MAPTRAB9AKMT2ATDP1
SCHEMBL6649334 0.75 SCD (0.42) SCDSCD5HCRTR2HCRTR1ALDH1A1
SCHEMBL6647313 0.74 SCD (0.40) SCDSCD5HCRTR2HCRTR1MAPT

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