SCHEMBL1275752

SCHEMBL1275752

CCc1cc(C(F)(C(F)(F)F)C(F)(F)F)cc(C)c1NC(=O)c1ccc(-n2cncn2)c(N)c1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.44
KDM4E B2RXH2 1/20 0.44
GAA P10253 1/20 0.44
CYP1A2 P05177 2/20 0.44
CYP2C9 P11712 2/20 0.44
CYP2C19 P33261 2/20 0.44
MAPT P10636 1/20 0.43
HPGD P15428 1/20 0.43
GRM7 Q14831 4/20 0.42
POLB P06746 1/20 0.41
CYP3A4 P08684 1/20 0.41
KMT2A Q03164 1/20 0.39

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
SCHEMBL14562854 0.96 ALDH1A1 (0.43) ALDH1A1KDM4EGAACYP1A2CYP2C9
SCHEMBL298774 0.95 ALDH1A1 (0.46) ALDH1A1KDM4EGAACYP1A2CYP2C9
SCHEMBL14563011 0.93 ALDH1A1 (0.48) ALDH1A1KDM4EGAACYP1A2CYP2C9
SCHEMBL17399561 0.92 ALDH1A1 (0.46) ALDH1A1KDM4EGAACYP1A2CYP2C9
SCHEMBL1275123 0.90 ALDH1A1 (0.44) ALDH1A1KDM4EGAACYP1A2CYP2C9
SCHEMBL9944023 0.89 ALDH1A1 (0.52) ALDH1A1KDM4EGAACYP1A2CYP2C9
SCHEMBL1274974 0.87 ALDH1A1 (0.42) ALDH1A1KDM4EGAACYP1A2CYP2C9
SCHEMBL9894411 0.87 ALDH1A1 (0.43) ALDH1A1KDM4EGAACYP1A2CYP2C9
SCHEMBL1275829 0.87 ALDH1A1 (0.43) ALDH1A1KDM4EGAACYP1A2CYP2C9
SCHEMBL9894428 0.86 POLB (0.60) ALDH1A1MAPTPOLBKMT2A

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
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
EP-2464624-A2 PESTICIDAL CARBOXAMIDES Bayer CropScience AG (DE) 2012-06-20 EP 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 ALDH1A1 1360/4885KDM4E 178/4885GAA 2556/4885

“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.