SCHEMBL11720652

SCHEMBL11720652

CNC(=O)Oc1ccc(NS(=O)(=O)c2ccc(C)cc2)c(C)c1

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 2/20 0.60
ALDH1A1 P00352 4/20 0.52
GAA P10253 3/20 0.52
GFER P55789 1/20 0.52
CYP2C9 P11712 3/20 0.51
CYP1A2 P05177 2/20 0.51
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
LMNA P02545 3/20 0.49
HTT P42858 2/20 0.49
CYP2C19 P33261 1/20 0.48
METAP2 P50579 1/20 0.47
KEAP1 Q14145 2/20 0.47
NFE2L2 Q16236 1/20 0.47
MRGPRX1 Q96LB2 1/20 0.46
HPGD P15428 1/20 0.46
HSD17B10 Q99714 1/20 0.46
CYTH2 Q99418 1/20 0.46

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
SCHEMBL11728054 0.82 ALDH1A1 (0.42) FFAR4ALDH1A1KEAP1NFE2L2HSD17B10
SCHEMBL11721266 0.81 FFAR4 (0.39) FFAR4ALDH1A1LMNAHTTHPGD
SCHEMBL11724512 0.80 CBX7 (0.42) FFAR4ALDH1A1LMNAMRGPRX1HPGD
SCHEMBL3513150 0.78 CYP2C9 (0.67) FFAR4ALDH1A1GAAGFERCYP2C9
SCHEMBL3513665 0.78 CYP2C9 (0.82) FFAR4ALDH1A1GAAGFERCYP2C9
SCHEMBL29048726 0.77 FFAR4 (0.77) FFAR4ALDH1A1GAAGFERMEN1
SCHEMBL11720165 0.77 BRD4 (0.41) ALDH1A1GAACYP2C9CYP2C19MRGPRX1
SCHEMBL11723641 0.77 MRGPRX1 (0.42) ALDH1A1MRGPRX1HSD17B10
SCHEMBL11718627 0.75 MRGPRX1 (0.47) MRGPRX1
SCHEMBL7178299 0.75 CYTH2 (0.73) FFAR4ALDH1A1GAAGFERCYP2C9

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
US-4051254-A SULFONAMIDO-AND AMIDOPHENYL N-METHYLCARBAMATES AND USE AS INSECTICIDES MOBIL OIL CORPORATION (US) 1977-09-27 US disclosed