SCHEMBL6067903

SCHEMBL6067903

Nc1ccsc1-c1c(O)cccc1O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 7/20 0.39
TSHR P16473 3/20 0.39
MAOA P21397 2/20 0.39
TDP1 Q9NUW8 7/20 0.38
ALDH1A1 P00352 7/20 0.38
HPGD P15428 6/20 0.38
HSD17B10 Q99714 6/20 0.38
MAPT P10636 6/20 0.38
LMNA P02545 4/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
MAPK1 P28482 2/20 0.38
HTT P42858 2/20 0.38
MAOB P27338 1/20 0.38
STAT3 P40763 1/20 0.34
RECQL P46063 4/20 0.33
CA2 P00918 3/20 0.33
CA1 P00915 2/20 0.33
EGFR P00533 2/20 0.33
FYN P06241 2/20 0.33
MMP9 P14780 2/20 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
SCHEMBL5712507 0.92 ALOX15 (0.41) ALOX15TSHRMAOATDP1ALDH1A1
SCHEMBL7135863 0.79 CES1 (0.36) TSHRALDH1A1HSD17B10MAPTMAPK1
SCHEMBL5712455 0.76 AURKA (0.40) ALOX15TSHRMAOATDP1ALDH1A1
SCHEMBL5712476 0.76 CD44 (0.39) ALOX15TSHRMAOAMAPTLMNA
SCHEMBL6067854 0.75 CYP2A6 (0.42) ALOX15TSHRMAOATDP1ALDH1A1
SCHEMBL6068093 0.75 MAOA (0.43) ALOX15TSHRMAOATDP1ALDH1A1
SCHEMBL3715393 0.74 CES1 (0.39) ALOX15TSHRALDH1A1HSD17B10MAPT
SCHEMBL5712439 0.72 ERN1 (0.41) ALOX15TSHRMAOATDP1ALDH1A1
SCHEMBL5712501 0.71 ALDH1A1 (0.38) ALOX15TSHRMAOATDP1ALDH1A1
SCHEMBL5712497 0.71 TSHR (0.40) ALOX15TSHRMAOATDP1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100349886-C 1, 3-dihydroxybenzene derivatives and coloring agents containing the same WELLA AG (US) 2007-11-21 CN disclosed
US-7125428-B2 1,3-Dihydroxybenzene derivatives and colorants containing said compounds WELLA AG (DE) 2006-10-24 US disclosed
CN-1633426-A 1, 3-dihydroxybenzene derivatives and coloring agents containing the same WELLA AG (US) 2005-06-29 CN disclosed
US-20040016063-A1 1,3-Dihydroxybenzene derivatives and colorants containing said compounds HFC PRESTIGE INTERNATIONAL HOLDING SWITZERLAND S.A.R.L (CH) 2004-01-29 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-20040016063-A1 1,3-Dihydroxybenzene derivatives and colorants containing said compounds KRT18, DSP, COL1A1 ALOX15 3186/4885TSHR 4633/4885MAOA 1084/4885

“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.