SCHEMBL28029960

SCHEMBL28029960

COc1ccc(Cl)cc1C(=O)NC(C)c1ccccc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.71
HPGD P15428 2/20 0.71
PTGER4 P35408 3/20 0.60
SMN1; SMN2 Q16637 1/20 0.60
GAA P10253 1/20 0.58
PKM P14618 1/20 0.58
PTGER2 P43116 2/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
GPR139 Q6DWJ6 1/20 0.56
LMNA P02545 2/20 0.56
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55
ROCK2 O75116 1/20 0.54
ROCK1 Q13464 1/20 0.54
TAS1R3 Q7RTX0 1/20 0.54
TAS1R1 Q7RTX1 1/20 0.54
PSMB5 P28074 1/20 0.53
USP2 O75604 1/20 0.53
HSD17B10 Q99714 2/20 0.53
NPSR1 Q6W5P4 1/20 0.53

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
SCHEMBL12838811 0.84 ALDH1A1 (0.76) ALDH1A1GAAL3MBTL1LMNAMEN1
SCHEMBL18767126 0.84 POLB (0.71) ALDH1A1HPGDSMN1; SMN2GAAPKM
SCHEMBL18767128 0.84 ALDH1A1 (0.71) ALDH1A1HPGDPTGER4SMN1; SMN2GAA
SCHEMBL11851295 0.84 ALDH1A1 (0.58) ALDH1A1HPGDPTGER4SMN1; SMN2PTGER2
SCHEMBL11848777 0.84 ALDH1A1 (0.58) ALDH1A1HPGDPTGER4SMN1; SMN2GAA
SCHEMBL18767127 0.83 ALDH1A1 (1.00) ALDH1A1HPGDSMN1; SMN2GAAPKM
SCHEMBL11854488 0.83 NLRP3 (0.62) ALDH1A1HPGDPTGER4SMN1; SMN2PTGER2
SCHEMBL18767129 0.83 ALDH1A1 (0.69) ALDH1A1HPGDSMN1; SMN2GAAPKM
SCHEMBL3687773 0.83 PTGER4 (0.56) ALDH1A1HPGDPTGER4SMN1; SMN2PTGER2
SCHEMBL4443073 0.83 ALDH1A1 (0.56) ALDH1A1HPGDL3MBTL1LMNAMEN1

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
CN-105237445-A Synthetic process of 4-[2-(5-chloro-2-methoxy benzamide)ethyl]benzsulfamide DALIAN JOIN KING BIOCHEM TECH CO LTD 2016-01-13 CN claimed
CN-105237445-A Synthetic process of 4-[2-(5-chloro-2-methoxy benzamide)ethyl]benzsulfamide DALIAN JOIN KING BIOCHEM TECH CO LTD 2016-01-13 CN disclosed