SCHEMBL9528826

SCHEMBL9528826

COC(=O)c1cnn(C)c1S(=O)(=O)Cl

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.40
CYP1A2 P05177 2/20 0.39
CYP2C19 P33261 2/20 0.39
TSHR P16473 1/20 0.36
MAPT P10636 1/20 0.35
KDM4E B2RXH2 4/20 0.35
ALDH1A1 P00352 4/20 0.35
NPC1 O15118 2/20 0.35
HPGD P15428 1/20 0.35
RAB9A P51151 1/20 0.35
HSD17B10 Q99714 1/20 0.35
MEN1 O00255 1/20 0.35
CYP2C9 P11712 1/20 0.35
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
CA9 Q16790 2/20 0.35
GAA P10253 2/20 0.35
CA5A P35218 1/20 0.35
GLA P06280 1/20 0.35
SPR P35270 1/20 0.35

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
SCHEMBL7809603 0.84 CA1 (0.45) KMT2ACYP1A2CYP2C19TSHRKDM4E
SCHEMBL7801314 0.83 ALDH1A1 (0.45) KMT2ATSHRMAPTKDM4EALDH1A1
SCHEMBL9204354 0.79 CYP1A2 (0.44) KMT2ACYP1A2CYP2C19TSHRKDM4E
SCHEMBL30951484 0.74 CNR2 (0.42) KMT2ACYP1A2CYP2C19KDM4EALDH1A1
SCHEMBL10184712 0.74 KMT2A (0.53) KMT2ACYP1A2CYP2C19TSHRMAPT
SCHEMBL28965242 0.74 CYP1A2 (0.50) KMT2ACYP1A2CYP2C19TSHRMAPT
SCHEMBL9201765 0.74 CYP1A2 (0.43) KMT2ACYP1A2CYP2C19TSHRKDM4E
SCHEMBL26117581 0.73 CYP1A2 (0.47) KMT2ACYP1A2CYP2C19TSHRMAPT
SCHEMBL27937688 0.73 CYP1A2 (0.39) KMT2ACYP1A2CYP2C19TSHRKDM4E
SCHEMBL17895911 0.73 CYP1A2 (0.46) KMT2ACYP1A2CYP2C19TSHRMAPT

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-0355385-B1 SUBSTITUTED 4-SULPHONYLAMINO-2-AZINYL-1,2,4-TRIAZOL-3-ONES, PROCESS AND INTERMEDIATES FOR THEIR PREPARATION AND THEIR USE AS HERBICIDES BAYER AG (DE) 1993-05-19 EP disclosed
US-5151514-A Triazine substituted herbicides BAYER AKTIENGESELLSCHAFT (DE) 1992-09-29 US disclosed
US-5142060-A Herbicidal substituted 4-sulphonylamino-2-azinyl-1,2,4-triazol-3-ones BAYER AKTIENGESELLSCHAFT (DE) 1992-08-25 US disclosed
US-5126454-A PROCESS FOR THE PREPARATION OF SULPHONYLISOUREAS BAYER AKTIENGESELLSCHAFT (DE) 1992-06-30 US disclosed
US-5089627-A Chemical intermediates therefor BAYER AKTIENGESELLSCHAFT (DE) 1992-02-18 US disclosed
US-5085687-A HERBICIDAL SUBSTITUTED 4-SULPHONYLAMINO-2-AZINYL-1,2,4-TRIAZOL-3-ONES BAYER AKTIENGESELLSCHAFT (DE) 1992-02-04 US disclosed
US-4988381-A HERBICIDES, PLANT GROWTH REGULATORS BAYER AKTIENGESELLSCHAFT (DE) 1991-01-29 US disclosed
EP-0355385-A1 Substituted 4-sulphonylamino-2-azinyl-1,2,4-triazol-3-ones, process and intermediates for their preparation and their use as herbicides BAYER AG (DE) 1990-02-28 EP disclosed