SCHEMBL5282524

SCHEMBL5282524

CCn1c(=NN=C(C)C)sc2ccccc21

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 4/20 0.55
TSHR P16473 4/20 0.55
ALDH1A1 P00352 3/20 0.55
MAPK1 P28482 1/20 0.55
KCNQ3 O43525 1/20 0.49
KCNQ2 O43526 1/20 0.49
MAPT P10636 5/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
HTT P42858 1/20 0.44
LMNA P02545 2/20 0.44
KMT2A Q03164 4/20 0.41
MEN1 O00255 2/20 0.41
TP53 P04637 1/20 0.40
RECQL P46063 1/20 0.40
CNR1 P21554 3/20 0.40
CNR2 P34972 3/20 0.40
HIF1A Q16665 1/20 0.40
CYP1A2 P05177 1/20 0.40

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
SCHEMBL5282522 1.00 NPSR1 (0.55) NPSR1TSHRALDH1A1MAPK1KCNQ3
SCHEMBL5284142 0.88 CNR1 (0.46) NPSR1TSHRALDH1A1MAPK1KCNQ3
SCHEMBL5284148 0.88 CNR1 (0.46) NPSR1TSHRALDH1A1MAPK1KCNQ3
SCHEMBL893600 0.87 ALDH1A1 (0.56) NPSR1TSHRALDH1A1MAPK1KCNQ3
SCHEMBL29387616 0.87 ALDH1A1 (0.56) NPSR1TSHRALDH1A1MAPK1KCNQ3
SCHEMBL4623996 0.87 ALDH1A1 (0.56) NPSR1TSHRALDH1A1MAPK1KCNQ3
SCHEMBL5284128 0.86 CNR1 (0.52) NPSR1TSHRALDH1A1MAPK1KCNQ3
SCHEMBL5284131 0.86 CNR1 (0.52) NPSR1TSHRALDH1A1MAPK1KCNQ3
SCHEMBL5283843 0.85 MAPT (0.45) NPSR1TSHRALDH1A1MAPK1KCNQ3
SCHEMBL5283710 0.84 MAPT (0.44) NPSR1TSHRALDH1A1MAPK1KCNQ3

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 9 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-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 NPSR1 2071/4885TSHR 4311/4885ALDH1A1 454/4885

“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.