SCHEMBL3582620

SCHEMBL3582620

Nc1ncccc1C(=O)NCc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 1/20 0.55
KMT2A Q03164 1/20 0.50
HPGD P15428 4/20 0.46
NSD2 O96028 1/20 0.46
PRKCI P41743 2/20 0.45
MAPK8 P45983 1/20 0.44
ATM Q13315 1/20 0.44
LMNA P02545 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
MAPK1 P28482 1/20 0.44
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
SORT1 Q99523 1/20 0.43
PDPK1 O15530 1/20 0.43

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
SCHEMBL920722 0.84 MAPK14 (0.61) HDAC6HPGDMAPK8LMNASMN1; SMN2
SCHEMBL3586286 0.83 HDAC6 (0.53) HDAC6KMT2AHPGDNSD2LMNA
SCHEMBL923044 0.83 KMT2A (0.70) HDAC6KMT2AHPGDNSD2LMNA
SCHEMBL3571438 0.82 HPGD (0.64) HDAC6KMT2AHPGDNSD2LMNA
SCHEMBL921272 0.82 MT-CO2 (0.54) HDAC6KMT2AHPGDNSD2PRKCI
SCHEMBL27824616 0.82 NSD2 (0.56) HDAC6KMT2AHPGDNSD2PRKCI
SCHEMBL922492 0.82 NSD2 (0.66) KMT2AHPGDNSD2PRKCIMAPK8
SCHEMBL921161 0.81 HPGD (0.56) HDAC6KMT2AHPGDNSD2PRKCI
SCHEMBL920122 0.81 HPGD (0.68) KMT2AHPGDNSD2PRKCILMNA
SCHEMBL921118 0.80 PRKCI (0.51) HDAC6KMT2AHPGDNSD2PRKCI

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 HDAC6 1130/4885KMT2A 341/4885HPGD 1361/4885

“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.