SCHEMBL13091077

SCHEMBL13091077

CCC(=O)N(CC)c1cc(C)ccc1C

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.52
▸ TP53 P04637 1/20 0.52
▸ TSHR P16473 4/20 0.48
▸ ALDH1A1 P00352 3/20 0.48
▸ HPGD P15428 3/20 0.48
▸ KDM4E B2RXH2 2/20 0.48
▸ HSD17B10 Q99714 2/20 0.48
▸ GLA P06280 1/20 0.48
▸ LMNA P02545 2/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ THRB P10828 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ MEN1 O00255 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ CYP3A4 P08684 2/20 0.40
▸ ALOX15 P16050 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ NLRP3 Q96P20 1/20 0.38
▸ PKM P14618 1/20 0.38
▸ MCL1 Q07820 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
SCHEMBL29940658 0.84 MAPT (0.47) MAPTTP53TSHRALDH1A1HPGD
SCHEMBL7867200 0.79 CYP3A4 (0.61) MAPTTP53TSHRALDH1A1HPGD
SCHEMBL30715126 0.78 MAPT (0.43) MAPTTP53TSHRALDH1A1HPGD
SCHEMBL30074142 0.72 POLQ (0.58) MAPTTP53ALDH1A1HPGDKDM4E
SCHEMBL3871929 0.72 POLQ (0.58) MAPTTP53ALDH1A1HPGDKDM4E
SCHEMBL18749573 0.72 MRGPRX4 (0.44) MAPTTSHRALDH1A1HPGDKDM4E
SCHEMBL10348155 0.71 ALDH1A1 (0.42) MAPTTP53ALDH1A1KDM4EHSD17B10
SCHEMBL20278053 0.71 SMN1; SMN2 (0.45) MAPTTP53TSHRALDH1A1HPGD
SCHEMBL11876798 0.71 MAPT (0.36) MAPTTP53TSHRALDH1A1HPGD
SCHEMBL8785163 0.70 TDP1 (0.40) MAPTTP53TSHRALDH1A1HPGD

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-2010123139-A1 ARYLCARBOXAMIDE DERIVATIVE HAVING SULFAMOYL GROUP 持田製薬株式会社 (JP) 2010-10-28 — — WO disclosed
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