SCHEMBL6136914

SCHEMBL6136914

CC(=O)c1ccsc1-c1cc(N)ccc1O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.41
KDM4E B2RXH2 4/20 0.41
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
TDP1 Q9NUW8 3/20 0.41
HPGD P15428 3/20 0.41
CASP1 P29466 3/20 0.41
CYP3A4 P08684 2/20 0.41
RECQL P46063 2/20 0.41
THRB P10828 2/20 0.41
ALOX15 P16050 2/20 0.41
CASP7 P55210 2/20 0.41
HSD17B10 Q99714 2/20 0.41
TNF P01375 1/20 0.41
HSPD1 P10809 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
PTGS2 P35354 1/20 0.41
KDR P35968 1/20 0.41
BRCA1 P38398 1/20 0.41

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
SCHEMBL5704965 0.89 KDM4E (0.44) ALDH1A1KDM4EMEN1KMT2ATDP1
SCHEMBL7800663 0.86 MAPT (0.39) ALDH1A1KDM4EMEN1KMT2ATDP1
Hydrochloric Acid SCHEMBL7809809 0.85 MAPT (0.41) ALDH1A1KDM4EMEN1KMT2ATDP1
SCHEMBL6136935 0.78 PDE10A (0.55) ALDH1A1KDM4EMEN1KMT2ATDP1
SCHEMBL1380105 0.77 PDE10A (0.42) ALDH1A1KDM4EMEN1KMT2ATDP1
SCHEMBL7800903 0.76 ALDH1A1 (0.33) ALDH1A1MEN1KMT2AHPGDRECQL
SCHEMBL1380335 0.75 KDM4E (0.43) ALDH1A1KDM4EMEN1KMT2ATDP1
SCHEMBL6137031 0.74 CA1 (0.50) ALDH1A1KDM4EMEN1KMT2ATDP1
SCHEMBL30238017 0.74 PTK2 (0.42) ALDH1A1KDM4EMEN1KMT2ATDP1
SCHEMBL6136919 0.74 ERN1 (0.38) ALDH1A1KDM4EMEN1KMT2ATDP1

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-1153917-B1 p-Aminophenol derivatives and colorants containing them WELLA AG (DE) 2005-04-13 EP claimed
US-6592631-B2 Useful as developer compounds in oxidation dye compositions for keratin fibers. WELLA AG (DE) 2003-07-15 US claimed
US-20010054207-A1 p-aminophenol derivative compounds and dye compositions containing same WELLA INTERNATIONAL OPERATIONS SWITZERLAND SARL (CH) 2001-12-27 US claimed
EP-1153917-A1 p-Aminophenol derivatives and colorants containing them Wella Aktiengesellschaft (DE) 2001-11-14 EP claimed
EP-1153917-B1 p-Aminophenol derivatives and colorants containing them WELLA AG (DE) 2005-04-13 EP disclosed
US-6592631-B2 Useful as developer compounds in oxidation dye compositions for keratin fibers. WELLA AG (DE) 2003-07-15 US disclosed
US-20010054207-A1 p-aminophenol derivative compounds and dye compositions containing same WELLA INTERNATIONAL OPERATIONS SWITZERLAND SARL (CH) 2001-12-27 US disclosed
EP-1153917-A1 p-Aminophenol derivatives and colorants containing them Wella Aktiengesellschaft (DE) 2001-11-14 EP 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-20010054207-A1 p-aminophenol derivative compounds and dye compositions containing same KRT18, AASDHPPT, S100P ALDH1A1 99/4885KDM4E 354/4885MEN1 4641/4885

“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.