SCHEMBL11308024

SCHEMBL11308024

CN(C)S(=O)(=O)c1ccc(OC(=O)c2ccc(NC(=N)N)cc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.62
SMN1; SMN2 Q16637 3/20 0.62
ALDH1A1 P00352 4/20 0.50
HSD17B10 Q99714 1/20 0.50
TSHR P16473 1/20 0.50
TRPV4 Q9HBA0 1/20 0.48
ATM Q13315 1/20 0.47
PRSS1 P07477 1/20 0.46
ACR P10323 1/20 0.46
KMT2A Q03164 2/20 0.46
MEN1 O00255 1/20 0.46
MAPK1 P28482 1/20 0.45
TP53 P04637 1/20 0.44

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
SCHEMBL11311435 0.98 MAPT (0.60) MAPTSMN1; SMN2ALDH1A1HSD17B10TSHR
SCHEMBL11302909 0.90 ALDH1A1 (0.51) MAPTSMN1; SMN2ALDH1A1HSD17B10TSHR
SCHEMBL11305611 0.89 MAPK1 (0.52) MAPTSMN1; SMN2ALDH1A1TSHRPRSS1
SCHEMBL11310818 0.88 SMN1; SMN2 (0.47) MAPTSMN1; SMN2ALDH1A1HSD17B10PRSS1
SCHEMBL11304751 0.88 SMN1; SMN2 (0.47) MAPTSMN1; SMN2ALDH1A1TSHRPRSS1
SCHEMBL11308308 0.87 ALDH1A1 (0.54) MAPTSMN1; SMN2ALDH1A1TSHRKMT2A
SCHEMBL11312223 0.87 MAPK1 (0.50) MAPTSMN1; SMN2ALDH1A1PRSS1ACR
SCHEMBL11302014 0.85 CA9 (0.55) MAPTSMN1; SMN2ALDH1A1KMT2AMEN1
SCHEMBL11304549 0.85 MAPK1 (0.48) MAPTSMN1; SMN2ALDH1A1PRSS1ACR
SCHEMBL9717022 0.85 PLG (0.60) MAPTSMN1; SMN2ALDH1A1PRSS1ACR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4283418-A ANTIPLASMIN AND ANTITRYPSIN AGENTS ONO PHARMACEUTICAL CO., LTD. (JP) 1981-08-11 US claimed
JP-55115865-A None JP disclosed
US-4283418-A ANTIPLASMIN AND ANTITRYPSIN AGENTS ONO PHARMACEUTICAL CO., LTD. (JP) 1981-08-11 US disclosed
JP-S55115865-A GUANIDINOBENZOIC ACID DERIVATIVE AND ITS PREPARATION ONO PHARMACEUT CO LTD 1980-09-06 JP disclosed