SCHEMBL3576350

SCHEMBL3576350

CNc1cnccc1C(=O)NCc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 1/20 0.47
SORT1 Q99523 2/20 0.46
NAMPT P43490 4/20 0.45
L3MBTL1 Q9Y468 1/20 0.43
TRPV1 Q8NER1 1/20 0.42
LSS P48449 1/20 0.42
MAPK1 P28482 1/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
HTT P42858 1/20 0.41
KMT2A Q03164 1/20 0.40
ROCK2 O75116 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
HDAC2 Q92769 1/20 0.40
HDAC6 Q9UBN7 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
SCHEMBL3576770 0.85 MT-CO2 (0.49) L3MBTL1MAPK1ALDH1A1LMNAMAPT
SCHEMBL3583119 0.83 HDAC2 (0.48) KDM4CSORT1NAMPTL3MBTL1TRPV1
SCHEMBL3586286 0.77 HDAC6 (0.53) ALDH1A1LMNAMAPTKMT2ASMN1; SMN2
SCHEMBL3576438 0.76 KDM4E (0.49) MAPK1ALDH1A1LMNAHTTKMT2A
SCHEMBL3572770 0.76 TSHR (0.66) NAMPTL3MBTL1ALDH1A1LMNAMAPT
SCHEMBL3583284 0.75 MAPK14 (0.54) SORT1LSSMAPK1ALDH1A1KMT2A
SCHEMBL3572599 0.74 MT-CO2 (0.45) L3MBTL1ALDH1A1LMNAMAPTHTT
SCHEMBL16676648 0.73 KDM4C (0.71) KDM4CALDH1A1
SCHEMBL3580598 0.73 MT-CO2 (0.47) LSSALDH1A1LMNAHTTKMT2A
SCHEMBL3576343 0.72 HDAC1 (0.52) L3MBTL1LSSLMNAHTTROCK2

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-7678818-B2 Anthranilamide and 2-amino-heteroarene-carboxamide compounds HOFFMANN-LA ROCHE INC. (US) 2010-03-16 US disclosed
US-20070219261-A1 Anthranilamide and 2-amino-heteroarene-carboxamide compounds HOFFMANN-LA ROCHE INC. 2007-09-20 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-20070219261-A1 Anthranilamide and 2-amino-heteroarene-carboxamide compounds AADAT, AAAS, AADAC KDM4C 2531/4885SORT1 4547/4885NAMPT 547/4885

“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.