SCHEMBL11723641

SCHEMBL11723641

CNC(=O)Oc1ccc(NS(=O)(=O)C2CC2)c(C)c1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MRGPRX1 Q96LB2 5/20 0.42
ACHE P22303 8/20 0.41
SMN1; SMN2 Q16637 2/20 0.39
MMP2 P08253 1/20 0.39
MMP9 P14780 1/20 0.39
MMP14 P50281 1/20 0.39
ALDH1A1 P00352 3/20 0.38
TSPO P30536 1/20 0.38
KDM4E B2RXH2 1/20 0.38
HSD17B10 Q99714 1/20 0.38
HRH1 P35367 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
SCHEMBL11724632 0.94 BRD4 (0.44) MRGPRX1ACHESMN1; SMN2KDM4EHSD17B10
SCHEMBL11728054 0.85 ALDH1A1 (0.42) ACHESMN1; SMN2ALDH1A1KDM4EHSD17B10
SCHEMBL11724512 0.80 CBX7 (0.42) MRGPRX1ACHESMN1; SMN2MMP2MMP9
SCHEMBL11721266 0.78 FFAR4 (0.39) ACHESMN1; SMN2MMP2MMP9MMP14
SCHEMBL11720652 0.77 FFAR4 (0.60) MRGPRX1ALDH1A1HSD17B10
SCHEMBL11720165 0.77 BRD4 (0.41) MRGPRX1SMN1; SMN2ALDH1A1KDM4E
SCHEMBL11720685 0.76 KDM4E (0.48) ACHEALDH1A1KDM4EHSD17B10
SCHEMBL11718627 0.75 MRGPRX1 (0.47) MRGPRX1
SCHEMBL12407120 0.74 FKBP1A (0.53) MRGPRX1ALDH1A1HRH1
SCHEMBL11720668 0.74 ALDH1A1 (0.50) ACHEALDH1A1

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