SCHEMBL9814877

SCHEMBL9814877

COC(=O)c1ccc(SC)cc1S(=O)(=O)NC(=O)Nc1nc(OC)cc(OC)n1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CDK1 P06493 1/20 0.55
GAA P10253 1/20 0.54
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
CYP1A2 P05177 1/20 0.41
MAPT P10636 3/20 0.39
TP53 P04637 1/20 0.39
GLA P06280 1/20 0.39
LMNA P02545 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
AGER Q15109 1/20 0.38
MAPK1 P28482 1/20 0.37
POLB P06746 1/20 0.37

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
SCHEMBL9835883 0.92 CDK1 (0.55) CDK1GAANPC1RAB9ACYP1A2
SCHEMBL11385667 0.86 CDK1 (0.57) CDK1GAACYP1A2MAPTTP53
SCHEMBL9826126 0.85 GAA (0.50) CDK1GAANPC1RAB9ACYP1A2
SCHEMBL8507050 0.85 CDK1 (0.56) CDK1GAACYP1A2MAPTTP53
SCHEMBL10395502 0.85 CDK1 (0.56) CDK1GAACYP1A2MAPTTP53
SCHEMBL1405765 0.83 GAA (0.59) CDK1GAANPC1CYP1A2MAPT
SCHEMBL10396053 0.83 CDK1 (0.62) CDK1GAANPC1CYP1A2MAPT
SCHEMBL8782215 0.83 CDK1 (0.62) CDK1GAACYP1A2MAPTTP53
SCHEMBL5846414 0.83 CDK1 (0.62) CDK1GAACYP1A2MAPTTP53
SCHEMBL18932247 0.83 CDK1 (0.51) CDK1GAACYP1A2MAPTTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4812441-A Hypocholesterolemically active protein derived from streptococcus KABUSHIKI KAISYA ADVANCE KAIHATSU KENKYUJO (JP) 1989-03-14 US claimed
EP-0162723-B1 HERBICIDAL SULFONAMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1991-05-29 EP disclosed
US-4981509-A Plant growth regulators E. I. DU PONT DE NEMOURS AND COMPANY (US) 1991-01-01 US disclosed
US-4871847-A Herbicidal sulfonamides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1989-10-03 US disclosed
US-4849010-A Herbicidal sulfonamides E. I. DUPONT DE NEMOURS AND COMPANY (US) 1989-07-18 US disclosed
US-4812441-A Hypocholesterolemically active protein derived from streptococcus KABUSHIKI KAISYA ADVANCE KAIHATSU KENKYUJO (JP) 1989-03-14 US disclosed
US-4812441-A Hypocholesterolemically active protein derived from streptococcus KABUSHIKI KAISYA ADVANCE KAIHATSU KENKYUJO (JP) 1989-03-14 US disclosed
US-4724039-A RICE CROP E. I. DU PONT DE NEMOURS AND COMPANY (US) 1988-02-09 US disclosed
US-4710221-A Herbicidal sulfonamides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1987-12-01 US disclosed
EP-0162723-A2 Herbicidal sulfonamides E.I. DU PONT DE NEMOURS AND COMPANY (US) 1985-11-27 EP disclosed