SCHEMBL6093501

SCHEMBL6093501

Nc1ccccc1C(=O)NCc1ccccn1

nearest known ligand 0.69

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HPGD P15428 8/20 0.69
ALDH1A1 P00352 5/20 0.69
LMNA P02545 2/20 0.66
HTT P42858 1/20 0.66
SMN1; SMN2 Q16637 1/20 0.61
L3MBTL1 Q9Y468 1/20 0.59
HSD17B10 Q99714 2/20 0.57
MEN1 O00255 2/20 0.57
KMT2A Q03164 2/20 0.57
RAB9A P51151 3/20 0.57
POLB P06746 2/20 0.57
NPC1 O15118 2/20 0.57
CA2 P00918 1/20 0.56
KDM4E B2RXH2 3/20 0.55
MAPK14 Q16539 1/20 0.53

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
SCHEMBL29433988 1.00 HPGD (0.69) HPGDALDH1A1LMNAHTTSMN1; SMN2
SCHEMBL9202857 0.83 HPGD (0.71) HPGDALDH1A1LMNAHTTSMN1; SMN2
SCHEMBL11829949 0.83 LMNA (0.72) HPGDALDH1A1LMNAHTTSMN1; SMN2
SCHEMBL28760388 0.82 HPGD (0.69) HPGDALDH1A1LMNAHTTSMN1; SMN2
SCHEMBL6382378 0.82 HPGD (0.69) HPGDALDH1A1LMNAHTTSMN1; SMN2
SCHEMBL11627488 0.82 HPGD (1.00) HPGDALDH1A1LMNAHTTSMN1; SMN2
SCHEMBL7220820 0.82 HPGD (0.69) HPGDALDH1A1LMNAHTTSMN1; SMN2
SCHEMBL5321616 0.82 HPGD (0.69) HPGDALDH1A1LMNAHTTSMN1; SMN2
SCHEMBL27660007 0.82 HPGD (0.69) HPGDALDH1A1LMNAHTTSMN1; SMN2
SCHEMBL10352818 0.81 HPGD (0.68) HPGDALDH1A1LMNAHTTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114276203-B Method for synthesizing 2-aminobenzamide compound by ultraviolet light induction 湖南大学 2023-03-31 CN disclosed
CN-114276203-A Method for synthesizing 2-aminobenzamide compound by ultraviolet light induction 湖南大学 2022-04-05 CN disclosed
US-9782407-B2 Substituted benzylamino quinolines as cholesterol ester-transfer protein inhibitors DR. REDDY'S LABORATORIES LTD. (IN) 2017-10-10 US disclosed
EP-1848430-B1 NOVEL BENZYLAMINE DERIVATIVES AS CETP INHIBITORS Dr Reddys Laboratories Ltd (IN) 2017-08-02 EP disclosed
EP-1981342-B1 SELECTIVE BENZYLAMINE DERIVATIVES AND THEIR UTILITY AS CHOLESTEROL ESTER-TRANSFER PROTEIN INHIBITORS REDDYS LAB LTD DR (IN) 2016-11-30 EP disclosed
CN-105229002-A BET protein inhibiting dihydropyridopyrazinones Bayer Pharma AG 2016-01-06 CN disclosed
US-20150216866-A1 SUBSTITUTED BENZYLAMINO QUINOLINES AS CHOLESTEROL ESTER-TRANSFER PROTEIN INHIBITORS DR. REDDY'S LABORATORIES LTD. (IN) 2015-08-06 US disclosed
US-9040558-B2 Substituted benzylamino quinolines as cholesterol ester-transfer protein inhibitors DR. REDDY'S LABORATORIES LTD. (IN) 2015-05-26 US disclosed
CN-101443006-B Novel benzylamine derivatives as CETP inhibitors REDDY US THERAPEUTICS INC 2012-10-10 CN disclosed
CN-101443006-A Novel benzylamine derivatives as CETP inhibitors REDDY US THERAPEUTICS INC (US) 2009-05-27 CN disclosed
US-20060178514-A1 Novel benzylamine derivatives as CETP inhibitors DR. REDDY'S LABORATORIES LTD. (IN) 2006-08-10 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 (2 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-20150216866-A1 SUBSTITUTED BENZYLAMINO QUINOLINES AS CHOLESTEROL ESTER-TRANSFER PROTEIN INHIBITORS CETP, NPC1, MTTP HPGD 2500/4885ALDH1A1 2612/4885LMNA 851/4885
US-20060178514-A1 Novel benzylamine derivatives as CETP inhibitors CETP, NPC1, LIPC HPGD 2541/4885ALDH1A1 4060/4885LMNA 344/4885

“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.