SCHEMBL5437242

SCHEMBL5437242

COc1c(C(=O)Nc2ccc(-n3ncc(C(F)(F)F)cc3=O)cc2)cc2ccc(F)cc2c1Cl

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 10/20 0.44
PTGES O14684 2/20 0.42
KMT2A Q03164 1/20 0.41
ATM Q13315 1/20 0.41
MAPT P10636 2/20 0.39
DPP4 P27487 1/20 0.38
MALT1 Q9UDY8 1/20 0.38
ALDH1A1 P00352 1/20 0.37
LMNA P02545 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
SCHEMBL5437236 0.85 MALT1 (0.38) MAPTMALT1
SCHEMBL5857748 0.66 CCR1 (0.60) NR3C1MAPTDPP4LMNA
SCHEMBL4679707 0.66 NPC1 (0.47) KMT2AMAPTLMNA
SCHEMBL5437243 0.64 KDM4E (0.41) MAPT
SCHEMBL12175284 0.64 CCR1 (0.63) NR3C1MAPTDPP4
SCHEMBL5382538 0.63 NPBWR1 (0.42) KMT2AATMMAPTALDH1A1LMNA
SCHEMBL1585024 0.62 NFKB1 (0.52) NR3C1ALDH1A1
SCHEMBL7020529 0.62 NPBWR1 (0.37) MAPTALDH1A1LMNA
SCHEMBL17982421 0.62 NR3C1 (1.00) NR3C1
SCHEMBL17963301 0.61 MAPT (0.53) NR3C1KMT2AMAPTDPP4ALDH1A1

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
US-RE39590-E1 Substituted benzene compounds, process for their preparation, and herbicidal and defoliant compositions containing them ISK AMERICAS INCORPORATED (US) 2007-04-24 US disclosed
US-6545161-B2 Potato and corn crops ISK AMERICAS INCORPORATED 2003-04-08 US disclosed
EP-1030843-A4 SUBSTITUTED BENZENE COMPOUNDS, PROCESS FOR THEIR PREPARATION, AND HERBICIDAL AND DEFOLIANT COMPOSITIONS CONTAINING THEM ISK AMERICAS INC (US) 2002-11-06 EP disclosed
US-20020133007-A1 Substituted benzene compounds, process for their preparation, and herbicidal and defoliant compositions containing them ISK AMERICAS INCORPORATED 2002-09-19 US disclosed
US-6355799-B1 PREEMERGENT HERBICIDE FOR CEREAL CROP FIELDS, DEFOLIANT FOR POTATO AND COTTON PLANTS ISK AMERICAS INCORPORATED 2002-03-12 US disclosed
EP-1030843-A1 SUBSTITUTED BENZENE COMPOUNDS, PROCESS FOR THEIR PREPARATION, AND HERBICIDAL AND DEFOLIANT COMPOSITIONS CONTAINING THEM ISK Americas Incorporated (US) 2000-08-30 EP disclosed
WO-1999021837-A1 SUBSTITUTED BENZENE COMPOUNDS, PROCESS FOR THEIR PREPARATION, AND HERBICIDAL AND DEFOLIANT COMPOSITIONS CONTAINING THEM ISK AMERICAS INCORPORATED (US) 1999-05-06 WO 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 (1 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-20020133007-A1 Substituted benzene compounds, process for their preparation, and herbicidal and defoliant compositions containing them DDT, CYP4X1, CYP1A1 NR3C1 2769/4885PTGES 3761/4885KMT2A 2175/4885

“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.