SCHEMBL4867080

SCHEMBL4867080

Cc1cc(O)nc(O)c1C.Cc1cc(O)nc(O)c1C

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.37
MAPT P10636 5/20 0.37
ACHE P22303 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
ALDH1A1 P00352 3/20 0.32
LMNA P02545 1/20 0.32
GAA P10253 1/20 0.32
HTT P42858 1/20 0.31
CYP3A4 P08684 2/20 0.31
ALOX15 P16050 2/20 0.31
PKM P14618 2/20 0.31
MAPK1 P28482 2/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
G6PD P11413 1/20 0.31
CYP2C9 P11712 1/20 0.31
HPGD P15428 1/20 0.31
ALOX12 P18054 1/20 0.31
CYP2C19 P33261 1/20 0.31

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
SCHEMBL29378184 1.00 KDM4E (0.37) KDM4EMAPTACHECA1CA2
SCHEMBL127356 1.00 KDM4E (0.37) KDM4EMAPTACHECA1CA2
Bromide SCHEMBL7236796 0.97 KDM4E (0.36) KDM4EMAPTACHECA1CA2
SCHEMBL7266704 0.81 ALDH1A1 (0.39) KDM4EMAPTACHECA1CA2
SCHEMBL10083611 0.81 KDM4E (0.36) KDM4EMAPTACHECA1CA2
SCHEMBL5265867 0.80 SIRT3 (0.37) RAB9A
SCHEMBL10758352 0.78 ACHE (0.46) KDM4EMAPTACHEALDH1A1LMNA
SCHEMBL3156421 0.78 CYP2C9 (0.31) ALDH1A1CYP2C9
SCHEMBL11292394 0.77 CYP3A4 (0.48) KDM4EMAPTALDH1A1GAACYP3A4
SCHEMBL5215727 0.74 SMN1; SMN2 (0.34) MAPTACHEALDH1A1LMNAGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7431742-B2 Hair coloring kits and methods of use thereof THE PROCTER & GAMBLE COMPANY (US) 2008-10-07 US disclosed
US-20070251025-A1 Hair coloring kits and methods of use thereof THE PROCTER & GAMBLE COMPANY 2007-11-01 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-20070251025-A1 Hair coloring kits and methods of use thereof COXFA4L2, SQOR, GPX4 KDM4E 1322/4885MAPT 3024/4885ACHE 2497/4885

“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.