SCHEMBL4951509

SCHEMBL4951509

Nc1ccc2ccn(O)c2c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PRKCI P41743 1/20 0.44
▸ ALDH1A1 P00352 4/20 0.38
▸ CYP3A4 P08684 3/20 0.38
▸ HSD17B10 Q99714 2/20 0.38
▸ MAPT P10636 4/20 0.37
▸ MEN1 O00255 3/20 0.37
▸ KMT2A Q03164 3/20 0.37
▸ CASP1 P29466 2/20 0.37
▸ CASP7 P55210 2/20 0.37
▸ HBB P68871 2/20 0.37
▸ HIF1A Q16665 2/20 0.37
▸ LMNA P02545 2/20 0.37
▸ HTT P42858 2/20 0.37
▸ ALOX15 P16050 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ F2 P00734 1/20 0.37
▸ CHRM2 P08172 1/20 0.37
▸ HTR1A P08908 1/20 0.37
▸ ADRA2A P08913 1/20 0.37
▸ ADORA3 P0DMS8 1/20 0.37

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
SCHEMBL4949317 0.76 CDC7 (0.44) CYP3A4HSD17B10MAPTHIF1AALOX15
SCHEMBL4955145 0.76 PRKCI (0.36) PRKCI
SCHEMBL4949297 0.76 PRKCI (0.45) PRKCIALDH1A1CYP3A4HSD17B10MAPT
SCHEMBL5718697 0.74 PRKCI (0.70) PRKCIALDH1A1CYP3A4HSD17B10MAPT
SCHEMBL29507010 0.74 PRKCI (0.70) PRKCIALDH1A1CYP3A4HSD17B10MAPT
SCHEMBL28083450 0.74 PRKCI (0.44) PRKCIALDH1A1CYP3A4HSD17B10MAPT
SCHEMBL398452 0.74 PRKCI (0.70) PRKCIALDH1A1CYP3A4HSD17B10MAPT
Hydrochloric Acid SCHEMBL397061 0.72 PRKCI (0.68) PRKCIALDH1A1CYP3A4HSD17B10MAPT
SCHEMBL28116940 0.72 LCK (0.47) ALDH1A1HSD17B10KMT2ALMNABRPF1
SCHEMBL11962998 0.71 NOTUM (0.58) PRKCIALDH1A1HSD17B10MAPTMEN1

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
US-7371264-B2 Keratin dyeing compounds, keratin dyeing compositions containing them, and use thereof THE PROCTER & GAMBLE COMPANY (US) 2008-05-13 — — US claimed
US-20060042026-A1 Keratin dyeing compounds, keratin dyeing compositions containing them, and use thereof THE PROCTER & GAMBLE COMPANY (US) 2006-03-02 — — US claimed
US-7371264-B2 Keratin dyeing compounds, keratin dyeing compositions containing them, and use thereof THE PROCTER & GAMBLE COMPANY (US) 2008-05-13 — — US disclosed
US-20060042026-A1 Keratin dyeing compounds, keratin dyeing compositions containing them, and use thereof THE PROCTER & GAMBLE COMPANY (US) 2006-03-02 — — 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-20060042026-A1 Keratin dyeing compounds, keratin dyeing compositions containing them, and use thereof KRT18, KDM5A, KDM5C PRKCI 916/4885ALDH1A1 510/4885CYP3A4 372/4885

“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.

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