SCHEMBL9894627

SCHEMBL9894627

Nc1ccc(C(=O)Nc2c(Cl)cc(C(F)(C(F)(F)F)C(F)(F)F)cc2Cl)cc1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 7/20 0.51
MEN1 O00255 5/20 0.45
KMT2A Q03164 5/20 0.45
LMNA P02545 4/20 0.45
POLB P06746 1/20 0.45
PKM P14618 1/20 0.45
APEX1 P27695 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
JAK2 O60674 1/20 0.41
JAK1 P23458 1/20 0.41
MAPT P10636 2/20 0.40
TLR7 Q9NYK1 1/20 0.40
PRMT1 Q99873 1/20 0.40
KDM4E B2RXH2 1/20 0.40
EPHX2 P34913 1/20 0.40
NR1H4 Q96RI1 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
SCHEMBL1275827 0.86 JAK2 (0.43) PTGS1MEN1KMT2ALMNAPOLB
SCHEMBL17399545 0.86 ALDH1A1 (0.48) MEN1KMT2APOLBTDP1MAPT
SCHEMBL18724342 0.85 MEN1 (0.44) PTGS1MEN1KMT2ALMNAPOLB
SCHEMBL3023983 0.83 MAPT (0.41) PTGS1MEN1KMT2ALMNAPOLB
SCHEMBL12931919 0.83 MEN1 (0.41) MEN1KMT2ALMNAPOLBMAPT
SCHEMBL4894565 0.82 MEN1 (0.56) PTGS1MEN1KMT2ALMNAPOLB
SCHEMBL1275465 0.82 MEN1 (0.48) MEN1KMT2ALMNAPOLBMAPT
SCHEMBL1274348 0.81 KCNJ11 (0.42) MEN1KMT2ALMNAPOLBPKM
SCHEMBL1275200 0.81 KCNJ11 (0.40) MEN1KMT2ALMNAPOLBPKM
SCHEMBL299598 0.80 KCNQ3 (0.39) MEN1KMT2ALMNAPOLBJAK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3153497-A2 PESTICIDAL CARBOXAMIDES Bayer Cropscience AG (DE) 2017-04-12 EP disclosed
EP-3153497-A2 PESTICIDAL CARBOXAMIDES Bayer Cropscience AG (DE) 2017-04-12 EP disclosed
US-9227923-B2 Pesticidal carboxamides BAYER INTELLECTUAL PROPERTY GMBH (DE) 2016-01-05 US disclosed
US-9227923-B2 Pesticidal carboxamides BAYER INTELLECTUAL PROPERTY GMBH (DE) 2016-01-05 US disclosed
US-9227923-B2 Pesticidal carboxamides BAYER INTELLECTUAL PROPERTY GMBH (DE) 2016-01-05 US disclosed
US-20120149910-A1 Pesticidal Carboxamides BAYER CROPSCIENCE AG (DE) 2012-06-14 US disclosed
US-20120149910-A1 Pesticidal Carboxamides BAYER CROPSCIENCE AG (DE) 2012-06-14 US disclosed
US-20120149910-A1 Pesticidal Carboxamides BAYER CROPSCIENCE AG (DE) 2012-06-14 US disclosed
WO-2011018170-A2 PESTICIDAL CARBOXAMIDES BAYER CROPSCIENCE AG (DE) 2011-02-17 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-20120149910-A1 Pesticidal Carboxamides DDT, ACHE, AADAC PTGS1 1959/4885MEN1 2546/4885KMT2A 183/4885

“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.