SCHEMBL9718299

SCHEMBL9718299

COc1cc(OC)nc(NC(=O)NS(=O)(=O)c2nc(Br)ccc2C(=O)N(C)C)n1

nearest known ligand 0.63

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CDK1 P06493 1/20 0.63
GAA P10253 1/20 0.55
CYP1A2 P05177 1/20 0.42
MAPT P10636 2/20 0.40
TP53 P04637 1/20 0.40
GLA P06280 1/20 0.40
KMT2A Q03164 2/20 0.38
ALOX15 P16050 1/20 0.35
MEN1 O00255 1/20 0.34
USP2 O75604 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL9718364 0.89 CDK1 (0.63) CDK1GAACYP1A2MAPTTP53
SCHEMBL9718396 0.88 CDK1 (0.65) CDK1GAACYP1A2MAPTTP53
SCHEMBL9363677 0.86 CDK1 (0.60) CDK1GAACYP1A2MAPTTP53
SCHEMBL9363351 0.85 CDK1 (0.59) CDK1GAACYP1A2MAPTTP53
SCHEMBL27259233 0.85 CDK1 (0.48) CDK1GAAMAPTTP53KMT2A
SCHEMBL9363588 0.85 CDK1 (0.59) CDK1GAACYP1A2MAPTTP53
Nicosulfuron SCHEMBL29440408 0.85 CDK1 (0.59) CDK1GAACYP1A2MAPTTP53
Nicosulfuron SCHEMBL22938 0.85 CDK1 (0.59) CDK1GAACYP1A2MAPTTP53
Nicosulfuron SCHEMBL8536419 0.85 CDK1 (0.59) CDK1GAACYP1A2MAPTTP53
Nicosulfuron SCHEMBL15524973 0.84 CDK1 (0.58) 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10206390-B2 Herbicidal suspension concentrate ROTAM AGROCHEM INTERNATIONAL COMPANY LIMITED (HK) 2019-02-19 US claimed
US-20140296071-A1 HERBICIDAL SUSPENSION CONCENTRATE ROTAM AGROCHEM INTERNATIONAL COMPANY LIMITED (HK) 2014-10-02 US claimed
EP-0388994-A1 Substituted pyridinesulfonamide compounds, herbicidal composition containing them, and method of preparing these compounds ISHIHARA SANGYO KAISHA, LTD. (JP) 1990-09-26 EP claimed
EP-0232067-A2 Substituted pyridinesulfonamide compounds, herbicidal composition containing them, and method of preparing these compounds ISHIHARA SANGYO KAISHA LTD. (JP) 1987-08-12 EP claimed
EP-0313317-B1 HERBICIDAL SUSPENSION CONCENTRATE ISHIHARA SANGYO KAISHA, LTD. (JP) 1992-04-22 EP disclosed
US-H750-H HERBICIDAL SUSPENSION CONCENTRATE ISHIHARA SANGYO KAISHA LTD. (JP) 1990-03-06 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20140296071-A1 HERBICIDAL SUSPENSION CONCENTRATE PFAS, DDT, STS CDK1 2378/4885GAA 659/4885CYP1A2 35/4885
US-10206390-B2 Herbicidal suspension concentrate PFAS, DDT, STS CDK1 2378/4885GAA 659/4885CYP1A2 35/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.