SCHEMBL8551209

SCHEMBL8551209

COC(=O)NNC(=S)NC1CC1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 5/20 0.58
SMN1; SMN2 Q16637 2/20 0.45
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
ALPL P05186 1/20 0.44
POLB P06746 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
LMNA P02545 2/20 0.43
HTT P42858 1/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
MAPT P10636 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
PKM P14618 1/20 0.41
ALDH1A1 P00352 2/20 0.40
TP53 P04637 1/20 0.40
CYP3A4 P08684 1/20 0.40

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
SCHEMBL8464579 0.75 EPHX1 (0.46) SMN1; SMN2POLBNPC1RAB9AMAPT
SCHEMBL2050427 0.75
SCHEMBL5099008 0.72
SCHEMBL10837318 0.72 GAA (0.50) GAAKMT2APOLBTDP1LMNA
SCHEMBL7745318 0.71
SCHEMBL23861325 0.71 GAA (0.61) GAASMN1; SMN2MEN1KMT2AALPL
SCHEMBL19281542 0.71 HTT (0.58) GAASMN1; SMN2MEN1KMT2AALPL
SCHEMBL19281527 0.71 HTT (0.53) GAASMN1; SMN2MEN1KMT2AALPL
SCHEMBL23735487 0.70 EPHX2 (0.56) SMN1; SMN2POLBLMNANPC1RAB9A
SCHEMBL11562573 0.69 SMN1; SMN2 (0.82) GAASMN1; SMN2MEN1KMT2APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0431291-B1 Sulfonylaminocarbony-triazolinones having substituents attached through sulfur BAYER AG (DE) 1998-07-29 EP disclosed
US-5599944-A Intermediates for herbicidal sulphonylaminocarbonyltriazolinones having substituents which are bonded via sulphur BAYER AKTIENGESELLSCHAFT (DE) 1997-02-04 US disclosed
US-5380863-A Herbicidal sulphonylaminocarbonyltriazolinones having substituents which are bonded via sulphur BAYER AKTIENGESELLSCHAFT (DE) 1995-01-10 US disclosed
US-5276162-A Herbicidal sulphonylaminocarbonyltriazolinones having substituents which are bonded via sulphur BAYER AKTIENGESELLSCHAFT (DE) 1994-01-04 US disclosed
US-5149356-A Herbicidal sulphonylaminocarbonyltriazolinones having substituents which are bonded via sulphur BAYER AKTIENGESELLSCHAFT (DE) 1992-09-22 US disclosed
US-5085684-A Herbicidal sulphonylaminocarbonyltriazolinones having substituents which are bonded via sulphur BAYER AKTIENGESELLSCHAFT (DE) 1992-02-04 US disclosed
EP-0431291-A2 Sulfonylaminocarbony-triazolinones having substituents attached through sulfur BAYER AG (DE) 1991-06-12 EP disclosed