SCHEMBL2954964

SCHEMBL2954964

Cc1cccc(Cl)c1NC(=O)c1cc(C(F)(F)F)nn1-c1ncccc1Cl

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDK1 Q15118 1/20 0.42
PDK2 Q15119 1/20 0.42
PDK3 Q15120 1/20 0.42
PDK4 Q16654 1/20 0.42
LCK P06239 6/20 0.41
CHRNA7 P36544 6/20 0.41
KLKB1 P03952 1/20 0.41
KDM4E B2RXH2 1/20 0.40
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
MAPT P10636 1/20 0.40
KMT2A Q03164 1/20 0.40
DHODH Q02127 1/20 0.40
CARM1 Q86X55 2/20 0.39
TRPV1 Q8NER1 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
SCHEMBL6677854 0.92 KDM4E (0.44) CHRNA7KLKB1KDM4EMEN1ALDH1A1
SCHEMBL12911821 0.91 CARM1 (0.41) KLKB1KDM4EMEN1ALDH1A1MAPT
SCHEMBL951281 0.90 KLKB1 (0.41) CHRNA7KLKB1DHODHCARM1
SCHEMBL6688876 0.89 KCNMA1 (0.42) KLKB1KDM4EMEN1ALDH1A1MAPT
SCHEMBL6677548 0.89 KDM4E (0.40) KLKB1KDM4EMEN1ALDH1A1MAPT
SCHEMBL12911572 0.88 DHODH (0.39) KLKB1KDM4EMEN1ALDH1A1MAPT
SCHEMBL29393434 0.88 DHODH (0.39) KLKB1KDM4EMEN1ALDH1A1MAPT
SCHEMBL1380391 0.88 DHODH (0.39) KLKB1KDM4EMEN1ALDH1A1MAPT
SCHEMBL12911831 0.87 CARM1 (0.43) KLKB1KDM4EMEN1ALDH1A1MAPT
SCHEMBL6713256 0.87 DHODH (0.41) KLKB1KDM4EMEN1ALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7754738-B2 Pyrazole and pyrrole carboxamide insecticides E.I. DU PONT DE NEMOURS AND COMPANY (US) 2010-07-13 US disclosed
US-20060167060-A1 Pyrazole and pyrrole carboxamide insecticides E. I. DU PONT DE NEMOURS AND COMPANY 2006-07-27 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 (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-20060167060-A1 Pyrazole and pyrrole carboxamide insecticides CBR3, C1S, CBR1 PDK1 288/4885PDK2 494/4885PDK3 214/4885

“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.