SCHEMBL3228583

SCHEMBL3228583

Nc1ccccc1NC(=O)/C=C/c1ccccc1

nearest known ligand 0.71

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EGFR P00533 7/20 0.71
MMP1 P03956 6/20 0.71
MMP2 P08253 6/20 0.71
MMP9 P14780 6/20 0.71
HDAC1 Q13547 8/20 0.69
HDAC4 P56524 2/20 0.64
MEF2D Q14814 2/20 0.64
EP300 Q09472 1/20 0.64
HDAC2 Q92769 3/20 0.64
HDAC3 O15379 1/20 0.64
MAOA P21397 1/20 0.62
MAOB P27338 1/20 0.62

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
SCHEMBL3228591 1.00 EGFR (0.71) EGFRMMP1MMP2MMP9HDAC1
SCHEMBL2640602 0.90 HDAC1 (0.66) EGFRMMP1MMP2MMP9HDAC1
SCHEMBL7978520 0.89 HDAC1 (0.64) EGFRMMP1MMP2MMP9HDAC1
SCHEMBL1059639 0.88 HDAC1 (0.63) EGFRMMP1MMP2MMP9HDAC1
SCHEMBL1059642 0.88 HDAC1 (0.63) EGFRMMP1MMP2MMP9HDAC1
SCHEMBL4536422 0.88 TRPA1 (0.68) EGFRMMP1MMP2MMP9HDAC1
SCHEMBL4536420 0.88 TRPA1 (0.68) EGFRMMP1MMP2MMP9HDAC1
SCHEMBL13180844 0.88 HDAC1 (0.74) EGFRMMP1MMP2MMP9HDAC1
SCHEMBL8348482 0.88 TRPA1 (0.68) EGFRMMP1MMP2MMP9HDAC1
SCHEMBL28633277 0.88 HDAC1 (0.63) EGFRMMP1MMP2MMP9HDAC1

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
US-20230202980-A1 N-(2-Aminophenyl)-Prop-2-Enamide Derivatives, and Uses Thereof in the Treatment of Cancer THE BRIGHAM AND WOMEN'S HOSPITAL, INC. 2023-06-29 US disclosed
US-20230202980-A1 N-(2-Aminophenyl)-Prop-2-Enamide Derivatives, and Uses Thereof in the Treatment of Cancer THE BRIGHAM AND WOMEN'S HOSPITAL, INC. 2023-06-29 US disclosed
EP-2238103-A1 NOVEL N-(2-AMINO-PHENYL)-AMIDE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2010-10-13 EP disclosed
US-7795315-B2 N-(2-amino-phenyl)-amide derivatives HOFFMAN-LA ROCHE INC. (US) 2010-09-14 US disclosed
US-20100028299-A1 Methods and compositions of treating a flaviviridae family viral infection THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY 2010-02-04 US disclosed
US-20090203681-A1 NOVEL N-(2-AMINO-PHENYL)-AMIDE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2009-08-13 US disclosed
WO-2009095324-A1 NOVEL N-(2-AMINO-PHENYL)-AMIDE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2009-08-06 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 (3 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-20230202980-A1 N-(2-Aminophenyl)-Prop-2-Enamide Derivatives, and Uses Thereof in the Treatment of Cancer SALL4, GLI2, GLI1 EGFR 261/4885MMP1 4680/4885MMP2 2852/4885
US-20090203681-A1 NOVEL N-(2-AMINO-PHENYL)-AMIDE DERIVATIVES MKI67, API5, BAD EGFR 652/4885MMP1 376/4885MMP2 97/4885
US-20100028299-A1 Methods and compositions of treating a flaviviridae family viral infection EIF2AK2, NSUN3, NSUN2 EGFR 3886/4885MMP1 881/4885MMP2 502/4885

“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.