SCHEMBL20051139

SCHEMBL20051139

CC(=O)Nc1c(F)ccc(NC(=O)c2cc(NC(=O)[C@H]3[C@H](c4ccc(Cl)c(C(F)(F)F)c4)C3(Cl)Cl)ccc2Cl)c1F

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
BRAF P15056 3/20 0.40
TMPRSS4 Q9NRS4 1/20 0.39
KMT2A Q03164 5/20 0.39
MEN1 O00255 4/20 0.39
LMNA P02545 2/20 0.39
MAPT P10636 2/20 0.38
MAPK1 P28482 1/20 0.38
ALDH1A1 P00352 1/20 0.37
RECQL P46063 1/20 0.37
TRPV1 Q8NER1 1/20 0.37
KDR P35968 1/20 0.36
KDM4E B2RXH2 1/20 0.36
PYGL P06737 1/20 0.35
GRM4 Q14833 1/20 0.35
TSHR P16473 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
SCHEMBL24281812 1.00 BRAF (0.40) BRAFTMPRSS4KMT2AMEN1LMNA
SCHEMBL20050563 0.97 KMT2A (0.39) BRAFTMPRSS4KMT2AMEN1LMNA
SCHEMBL20901147 0.94 MEN1 (0.39) BRAFTMPRSS4KMT2AMEN1LMNA
SCHEMBL21079060 0.94 BRAF (0.42) BRAFTMPRSS4KMT2AMEN1LMNA
SCHEMBL23465220 0.94 TMPRSS4 (0.39) BRAFTMPRSS4KMT2AMEN1LMNA
SCHEMBL20050385 0.93 BRAF (0.39) BRAFTMPRSS4KMT2AMEN1LMNA
SCHEMBL24281334 0.93 BRAF (0.39) BRAFTMPRSS4KMT2AMEN1LMNA
SCHEMBL24281723 0.92 BRAF (0.38) BRAFTMPRSS4KMT2AMEN1LMNA
SCHEMBL20051616 0.92 BRAF (0.38) BRAFTMPRSS4KMT2AMEN1LMNA
SCHEMBL20901097 0.92 KMT2A (0.40) BRAFKMT2AMEN1LMNAMAPT

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
EP-3971166-A1 MOLECULES HAVING PESTICIDAL UTILITY, AND COMPOSITIONS, AND PROCESSES, RELATED THERETO Corteva Agriscience LLC (US) 2022-03-23 EP disclosed
US-10993440-B2 Molecules having pesticidal utility, and intermediates, compositions, and processes related thereto DOW AGROSCIENCES LLC (US) 2021-05-04 US disclosed
US-20190166847-A1 MOLECULES HAVING PESTICIDAL UTILITY, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2019-06-06 US disclosed
US-20190150452-A1 MOLECULES HAVEING PESTICIDAL UTILIY AND INTERMEDIATES, COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2019-05-23 US disclosed
US-10258045-B2 Molecules having pesticidal utility and intermediates, compositions and processes related thereto DOW AGROSCIENCES LLC (US) 2019-04-16 US disclosed
US-20180098541-A1 MOLECULES HAVEING PESTICIDAL UTILIY AND INTERMEDIATES, COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2018-04-12 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 (5 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-20180098541-A1 MOLECULES HAVEING PESTICIDAL UTILIY AND INTERMEDIATES, COMPOSITIONS AND PROCESSES RELATED THERETO ACHE, DDT, MLYCD BRAF 3217/4885TMPRSS4 3667/4885KMT2A 2547/4885
US-20190166847-A1 MOLECULES HAVING PESTICIDAL UTILITY, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES RELATED THERETO ACHE, DDT, MLYCD BRAF 3334/4885TMPRSS4 3352/4885KMT2A 2668/4885
US-10993440-B2 Molecules having pesticidal utility, and intermediates, compositions, and processes related thereto ACHE, DDT, MLYCD BRAF 3334/4885TMPRSS4 3352/4885KMT2A 2668/4885
US-10258045-B2 Molecules having pesticidal utility and intermediates, compositions and processes related thereto ACHE, DDT, MLYCD BRAF 3319/4885TMPRSS4 3689/4885KMT2A 3043/4885
US-20190150452-A1 MOLECULES HAVEING PESTICIDAL UTILIY AND INTERMEDIATES, COMPOSITIONS AND PROCESSES RELATED THERETO ACHE, DDT, MLYCD BRAF 3217/4885TMPRSS4 3667/4885KMT2A 2547/4885

“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.