SCHEMBL5285754

SCHEMBL5285754

CC(C)=NN=c1sc(-c2ccccc2)c(-c2ccccc2)n1C(C)C

nearest known ligand 0.31

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.31
PTGS2 P35354 1/20 0.31
TSHR P16473 2/20 0.31
LMNA P02545 1/20 0.31
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
ALOX15 P16050 1/20 0.30
HSD17B10 Q99714 1/20 0.30
HPGD P15428 1/20 0.30

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
SCHEMBL5286269 1.00 PTGS1 (0.31) PTGS1PTGS2TSHRLMNAKDM4E
SCHEMBL5285831 0.86 ALDH1A1 (0.38) TSHRLMNAKDM4EALDH1A1ALOX15
SCHEMBL5285829 0.86 ALDH1A1 (0.38) TSHRLMNAKDM4EALDH1A1ALOX15
SCHEMBL5298282 0.81 ALDH1A1 (0.37) PTGS2LMNAKDM4EALDH1A1HSD17B10
SCHEMBL5298274 0.81 ALDH1A1 (0.37) PTGS2LMNAKDM4EALDH1A1HSD17B10
SCHEMBL5283709 0.80 ALDH1A1 (0.35) TSHRLMNAKDM4EALDH1A1HSD17B10
SCHEMBL5291224 0.80 ALDH1A1 (0.35) TSHRLMNAKDM4EALDH1A1HSD17B10
SCHEMBL4615561 0.80 PTGS2 (0.36) PTGS1PTGS2KDM4EALDH1A1ALOX15
SCHEMBL4615558 0.80 PTGS2 (0.36) PTGS1PTGS2KDM4EALDH1A1ALOX15
SCHEMBL5282883 0.79 CYP2C9 (0.37) PTGS1PTGS2LMNAKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1599178-B1 MEANS AND METHOD FOR DYEING KERATIN FIBRES WELLA AG (DE) 2007-12-19 EP claimed
US-7294151-B2 Means and method for dyeing keratin fibres WELLA AG (DE) 2007-11-13 US claimed
US-20060070190-A1 Means and method for dyeing keratin fibres KOYO SEIKO CO., LTD. (JP) 2006-04-06 US claimed
EP-1599178-A1 MEANS AND METHOD FOR DYEING KERATIN FIBRES Wella Aktiengesellschaft (DE) 2005-11-30 EP claimed
WO-2004078151-A1 MEANS AND METHOD FOR DYEING KERATIN FIBRES WELLA AKTIENGESELLSCHAFT (DE) 2004-09-16 WO claimed
EP-1599178-B1 MEANS AND METHOD FOR DYEING KERATIN FIBRES WELLA AG (DE) 2007-12-19 EP disclosed
US-7294151-B2 Means and method for dyeing keratin fibres WELLA AG (DE) 2007-11-13 US disclosed
US-20060070190-A1 Means and method for dyeing keratin fibres KOYO SEIKO CO., LTD. (JP) 2006-04-06 US disclosed
EP-1599178-A1 MEANS AND METHOD FOR DYEING KERATIN FIBRES Wella Aktiengesellschaft (DE) 2005-11-30 EP disclosed
WO-2004078151-A1 MEANS AND METHOD FOR DYEING KERATIN FIBRES WELLA AKTIENGESELLSCHAFT (DE) 2004-09-16 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-20060070190-A1 Means and method for dyeing keratin fibres KRT18, KLK5, KIT PTGS1 1735/4885PTGS2 2330/4885TSHR 4311/4885

“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.