SCHEMBL6139202

SCHEMBL6139202

Cc1ccc(NC(=O)/C=C/c2cc(N)ccc2N)cc1O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.48
▸ TP53 P04637 2/20 0.48
▸ SMN1; SMN2 Q16637 2/20 0.48
▸ THRB P10828 1/20 0.48
▸ KDM1A O60341 2/20 0.46
▸ SNCA P37840 2/20 0.46
▸ TSHR P16473 1/20 0.44
▸ CASP1 P29466 1/20 0.44
▸ KMT2A Q03164 2/20 0.43
▸ POLB P06746 2/20 0.43
▸ APAF1 O14727 1/20 0.43
▸ USP2 O75604 1/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ UBE2N P61088 1/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43
▸ ALDH1A1 P00352 3/20 0.43
▸ MMP1 P03956 2/20 0.42
▸ MMP2 P08253 2/20 0.42
▸ MMP9 P14780 2/20 0.42
▸ CYP1A2 P05177 2/20 0.42

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
SCHEMBL6139207 1.00 MAPT (0.48) MAPTTP53SMN1; SMN2THRBKDM1A
Hydrochloric Acid SCHEMBL6139089 0.99 MAPT (0.47) MAPTTP53SMN1; SMN2THRBKDM1A
Hydrochloric Acid SCHEMBL6139093 0.99 MAPT (0.47) MAPTTP53SMN1; SMN2THRBKDM1A
SCHEMBL6096212 0.91 SNCA (0.57) MAPTTP53SMN1; SMN2THRBKDM1A
SCHEMBL6096207 0.91 SNCA (0.57) MAPTTP53SMN1; SMN2THRBKDM1A
Hydrochloric Acid SCHEMBL6098208 0.90 SNCA (0.56) MAPTTP53SMN1; SMN2THRBKDM1A
Hydrochloric Acid SCHEMBL6098211 0.90 SNCA (0.56) MAPTTP53SMN1; SMN2THRBKDM1A
SCHEMBL6096818 0.90 SNCA (0.59) MAPTTP53SMN1; SMN2THRBSNCA
SCHEMBL6096814 0.90 SNCA (0.59) MAPTTP53SMN1; SMN2THRBSNCA
SCHEMBL6138676 0.84 SNCA (0.51) MAPTKDM1ASNCAKMT2APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1263712-B1 3-(2,5-DIAMINOPHENYL)-ACRYLAMIDE DERIVATIVES AND COLOURING AGENTS CONTAINING SAID COMPOUNDS WELLA AG (DE) 2005-12-14 — — EP disclosed
US-6699990-B2 COLORFASTNESS; WATERPROOFING; OXIDATIVE COLOR HAIR DYES WELLA AKTIENGESELLSCHAFT (DE) 2004-03-02 — — US disclosed
US-20030140431-A1 3-(2,5-Diaminophenyl)-acrylamide derivatives and colouring agents containing said compounds HFC PRESTIGE INTERNATIONAL OPERATIONS SWITZERLAND SÀRL (CH) 2003-07-31 — — US disclosed
EP-1263712-A1 3-(2,5-DIAMINOPHENYL)-ACRYLAMIDE DERIVATIVES AND COLOURING AGENTS CONTAINING SAID COMPOUNDS Wella Aktiengesellschaft (DE) 2002-12-11 — — EP disclosed
WO-2002074731-A1 3-(2,5-DIAMINOPHENYL)-ACRYLAMIDE DERIVATIVES AND COLOURING AGENTS CONTAINING SAID COMPOUNDS WELLA AKTIENGESELLSCHAFT (DE) 2002-09-26 — — 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 (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-20030140431-A1 3-(2,5-Diaminophenyl)-acrylamide derivatives and colouring agents containing said compounds DPYD, AOC1, GPX4 MAPT 755/4885TP53 978/4885SMN1; SMN2 719/4885

“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.

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