SCHEMBL10101636

SCHEMBL10101636

CSc1cc(C)cc(C)c1C(C)=O

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.44
NPSR1 Q6W5P4 2/20 0.39
MAPT P10636 1/20 0.37
PKM P14618 1/20 0.37
TAS1R3 Q7RTX0 2/20 0.36
TAS1R1 Q7RTX1 2/20 0.36
TAS1R2 Q8TE23 2/20 0.36
HPGD P15428 3/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
CYP3A4 P08684 1/20 0.35
KDM4E B2RXH2 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
LMNA P02545 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
MCOLN3 Q8TDD5 1/20 0.35
ALDH1A1 P00352 2/20 0.35

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
SCHEMBL698413 0.82 KDM4E (0.46) NPSR1MAPTTAS1R3TAS1R1TAS1R2
SCHEMBL12248802 0.74 ALDH1A1 (0.40) GAANPSR1HPGDMEN1KMT2A
SCHEMBL2648126 0.74 CYP3A4 (0.54) HPGDMEN1KMT2ACYP3A4SMN1; SMN2
SCHEMBL30597490 0.74 CYP3A4 (0.54) HPGDMEN1KMT2ACYP3A4SMN1; SMN2
SCHEMBL11993986 0.73 GAA (0.47) GAAMAPTPKMMEN1KMT2A
SCHEMBL16976467 0.72 KDM4E (0.39) NPSR1TAS1R3TAS1R1TAS1R2HPGD
SCHEMBL24333565 0.71 GAA (0.41) GAANPSR1TAS1R3TAS1R1HPGD
SCHEMBL27964400 0.71 KDM4E (0.57) GAAHPGDCYP3A4KDM4EL3MBTL1
SCHEMBL11756480 0.71 MAPT (0.55) GAAMAPTPKMHPGDMEN1
SCHEMBL31162472 0.70 TAS1R3 (0.41) NPSR1MAPTTAS1R3TAS1R1TAS1R2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2412768-A9 Inkjet ink composition, inkjet recording method, and printed material Fujifilm Corporation (JP) 2012-07-11 EP disclosed
EP-2412768-A2 Inkjet ink composition, inkjet recording method, and printed material Fujifilm Corporation (JP) 2012-02-01 EP disclosed