SCHEMBL5280076

SCHEMBL5280076

CC(C)=NN=c1sc2ccc(S(=O)(=O)O)cc2n1C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.40
NPC1 O15118 8/20 0.40
RAB9A P51151 7/20 0.40
SMN1; SMN2 Q16637 4/20 0.40
HTT P42858 1/20 0.40
KMT2A Q03164 6/20 0.40
MEN1 O00255 5/20 0.40
TSHR P16473 1/20 0.37
RXFP1 Q9HBX9 4/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
ALDH1A1 P00352 4/20 0.34
KDM4E B2RXH2 2/20 0.34
TP53 P04637 1/20 0.34
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C19 P33261 1/20 0.33
KCNQ3 O43525 1/20 0.33
KCNQ2 O43526 1/20 0.33
LMNA P02545 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33

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
SCHEMBL5280074 1.00 MAPT (0.40) MAPTNPC1RAB9ASMN1; SMN2HTT
SCHEMBL5279659 0.90 TSHR (0.46) MAPTNPC1RAB9ASMN1; SMN2HTT
SCHEMBL5279665 0.90 TSHR (0.46) MAPTNPC1RAB9ASMN1; SMN2HTT
SCHEMBL4613896 0.83 NPC1 (0.40) MAPTNPC1RAB9ASMN1; SMN2KMT2A
SCHEMBL4613895 0.83 NPC1 (0.40) MAPTNPC1RAB9ASMN1; SMN2KMT2A
SCHEMBL11385267 0.79 TSHR (0.51) MAPTNPC1RAB9ASMN1; SMN2KMT2A
SCHEMBL5280934 0.78 MAPT (0.50) MAPTNPC1RAB9ASMN1; SMN2HTT
SCHEMBL5280930 0.78 MAPT (0.50) MAPTNPC1RAB9ASMN1; SMN2HTT
SCHEMBL5373869 0.76 TSHR (0.44) MAPTNPC1RAB9ASMN1; SMN2HTT
SCHEMBL5283690 0.76 TSHR (0.44) MAPTNPC1RAB9ASMN1; SMN2HTT

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 8 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

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 MAPT 1807/4885NPC1 4843/4885RAB9A 3143/4885

“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.