SCHEMBL5164555

SCHEMBL5164555

Cc1ccccc1NC(=O)Cc1cc(O)ccc1N

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 7/20 0.55
ALDH1A1 P00352 5/20 0.50
ALOX12 P18054 1/20 0.49
RAB9A P51151 2/20 0.49
NPC1 O15118 1/20 0.49
MAPT P10636 2/20 0.48
MAPK1 P28482 2/20 0.48
HSD17B10 Q99714 2/20 0.48
SMN1; SMN2 Q16637 1/20 0.46
HDAC3 O15379 1/20 0.46
HDAC4 P56524 1/20 0.46
HDAC1 Q13547 1/20 0.46
HDAC7 Q8WUI4 1/20 0.46
HDAC2 Q92769 1/20 0.46
HDAC10 Q969S8 1/20 0.46
HDAC11 Q96DB2 1/20 0.46
HDAC8 Q9BY41 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
HDAC9 Q9UKV0 1/20 0.46
HDAC5 Q9UQL6 1/20 0.46

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
SCHEMBL5163222 0.86 MAPT (0.53) HPGDALDH1A1RAB9ANPC1MAPT
SCHEMBL5162715 0.84 KMT2A (0.50) HPGDALDH1A1RAB9ANPC1HDAC1
SCHEMBL5163655 0.84 RAB9A (0.48) ALDH1A1RAB9ANPC1MAPTSMN1; SMN2
SCHEMBL5159762 0.84 KMT2A (0.51) HPGDALDH1A1RAB9ANPC1MAPT
SCHEMBL5160096 0.83 ALDH1A1 (0.60) ALDH1A1MAPTHSD17B10SMN1; SMN2LMNA
SCHEMBL5164585 0.83 KCNQ2 (0.53) HPGDALDH1A1MAPTHSD17B10SMN1; SMN2
SCHEMBL5162988 0.81 POLB (0.50) HPGDALDH1A1RAB9ASMN1; SMN2HDAC3
SCHEMBL5162130 0.81 GAA (0.50) ALDH1A1RAB9ANPC1MAPTMAPK1
SCHEMBL3815239 0.80 CYP1A2 (0.53) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL5164822 0.80 MEN1 (0.58) ALDH1A1RAB9ANPC1MAPTMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070067922-A1 4-Aminophenol derivatives and colorants comprising these compounds PROCTER & GAMBLE COMPANY, THE 2007-03-29 US claimed
EP-1762218-A1 4-aminophenol derivatives and colorants comprising these compounds Wella Aktiengesellschaft (DE) 2007-03-14 EP claimed
WO-2007026313-A2 4-AMINOPHENOL DERIVATIVES AND COLORANTS COMPRISING THESE COMPOUNDS THE PROCTER & GAMBLE COMPANY (US) 2007-03-08 WO claimed
US-20070067922-A1 4-Aminophenol derivatives and colorants comprising these compounds PROCTER & GAMBLE COMPANY, THE 2007-03-29 US disclosed
EP-1762218-A1 4-aminophenol derivatives and colorants comprising these compounds Wella Aktiengesellschaft (DE) 2007-03-14 EP disclosed
WO-2007026313-A2 4-AMINOPHENOL DERIVATIVES AND COLORANTS COMPRISING THESE COMPOUNDS THE PROCTER & GAMBLE COMPANY (US) 2007-03-08 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-20070067922-A1 4-Aminophenol derivatives and colorants comprising these compounds KRT18, S100A4, CKAP4 HPGD 565/4885ALDH1A1 309/4885ALOX12 3052/4885

“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.