SCHEMBL9814721

SCHEMBL9814721

CCOc1ccc(C(=O)OC)c(S)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.55
KDM4E B2RXH2 3/20 0.50
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
KMT2A Q03164 2/20 0.43
PLK1 P53350 1/20 0.42
POLB P06746 1/20 0.42
MEN1 O00255 1/20 0.42
LMNA P02545 1/20 0.42
CYP1A2 P05177 1/20 0.42
ALDH1A1 P00352 4/20 0.42
HIF1A Q16665 1/20 0.42
KLKB1 P03952 1/20 0.42
GAA P10253 2/20 0.41
HPGD P15428 2/20 0.41
HSD17B10 Q99714 2/20 0.41
GLA P06280 1/20 0.41
CASP1 P29466 1/20 0.41
CASP7 P55210 1/20 0.41
ATM Q13315 1/20 0.41

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
SCHEMBL21543853 0.85 TDP1 (0.55) TDP1KDM4ENPC1RAB9AKMT2A
SCHEMBL7797959 0.84 TDP1 (0.58) TDP1KDM4ENPC1RAB9AKMT2A
SCHEMBL787525 0.83 KDM4E (0.56) KDM4ENPC1RAB9AKMT2APOLB
SCHEMBL3207510 0.82 CA12 (0.64) TDP1KDM4ENPC1RAB9AKMT2A
SCHEMBL16955174 0.82 TDP1 (0.52) TDP1KDM4ENPC1RAB9AKMT2A
SCHEMBL4125549 0.81 MAOB (0.58) KDM4ENPC1RAB9AKMT2AMEN1
SCHEMBL21447016 0.81 TDP1 (0.51) TDP1KDM4ENPC1RAB9AKMT2A
SCHEMBL16955172 0.81 TDP1 (0.51) TDP1KDM4ENPC1RAB9AKMT2A
SCHEMBL10362606 0.81 ALDH1A1 (0.58) TDP1KDM4ENPC1RAB9AKMT2A
SCHEMBL31459933 0.81 KDM4E (0.54) TDP1KDM4ENPC1RAB9AKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-4877442-A Herbicidal sulfonamides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1989-10-31 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-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