SCHEMBL9200620

SCHEMBL9200620

COC(=O)c1c(S(=O)(=O)N=C=O)c(C)nn1C

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.36
HPGD P15428 3/20 0.35
ALDH1A1 P00352 3/20 0.34
NPSR1 Q6W5P4 1/20 0.34
KDM4E B2RXH2 2/20 0.34
HSD17B10 Q99714 1/20 0.34
TSHR P16473 2/20 0.33
MEN1 O00255 1/20 0.31
PRNP P04156 1/20 0.31
POLB P06746 1/20 0.31
KMT2A Q03164 1/20 0.31
RXFP1 Q9HBX9 1/20 0.31
LMNA P02545 2/20 0.31
USP2 O75604 1/20 0.31
GLA P06280 1/20 0.31
ALOX12 P18054 1/20 0.31
FPR2 P25090 1/20 0.30
PROKR1 Q8TCW9 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL9200764 0.78 HPGD (0.50) L3MBTL1HPGDALDH1A1NPSR1KDM4E
SCHEMBL7813710 0.78 KDM4E (0.41) L3MBTL1HPGDALDH1A1NPSR1KDM4E
SCHEMBL9196596 0.77 FPR2 (0.36) L3MBTL1ALDH1A1NPSR1TSHRLMNA
SCHEMBL729060 0.70 L3MBTL1 (0.46) L3MBTL1HPGDALDH1A1NPSR1KDM4E
SCHEMBL25759724 0.69 SMN1; SMN2 (0.50) L3MBTL1ALDH1A1NPSR1KDM4EMEN1
SCHEMBL9194890 0.69 KDM4E (0.42) L3MBTL1HPGDALDH1A1NPSR1KDM4E
SCHEMBL9199473 0.69 SMN1; SMN2 (0.33) TSHRLMNASMN1; SMN2
SCHEMBL19555815 0.67 KDM4E (0.41) L3MBTL1HPGDALDH1A1NPSR1KDM4E
SCHEMBL11272207 0.67 KDM4E (0.45) L3MBTL1HPGDALDH1A1KDM4EHSD17B10
SCHEMBL9197499 0.66 HTT (0.48) ALDH1A1TSHRLMNASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0087780-B2 Pyrazolesulfonylurea derivative, preparation thereof, herbicide containing said derivative as active ingredient and herbicidal method by use thereof NISSAN CHEMICAL IND LTD (JP) 1995-02-15 EP disclosed
US-4954164-A Pyrazolesulfonylurea derivatives, preparation thereof, herbicide containing said derivative as active ingredient and herbicidal method by use thereof NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 1990-09-04 US disclosed
EP-0087780-A2 Pyrazolesulfonylurea derivative, preparation thereof, herbicide containing said derivative as active ingredient and herbicidal method by use thereof NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1983-09-07 EP disclosed