SCHEMBL5374769

SCHEMBL5374769

OC1CCN(c2cnc(-c3ccccc3)n2-c2ccccc2)C1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AURKA O14965 2/20 0.40
IRAK4 Q9NWZ3 2/20 0.40
CDC7 O00311 1/20 0.40
PLK4 O00444 1/20 0.40
CHEK1 O14757 1/20 0.40
PDPK1 O15530 1/20 0.40
JAK2 O60674 1/20 0.40
ROCK2 O75116 1/20 0.40
PAK4 O96013 1/20 0.40
CHEK2 O96017 1/20 0.40
EGFR P00533 1/20 0.40
NTRK1 P04629 1/20 0.40
PRKCG P05129 1/20 0.40
INSR P06213 1/20 0.40
LCK P06239 1/20 0.40
FYN P06241 1/20 0.40
CDK1 P06493 1/20 0.40
LYN P07948 1/20 0.40
MET P08581 1/20 0.40
PIM1 P11309 1/20 0.40

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
SCHEMBL5378305 0.85 AVPR1A (0.40) IRAK4ALDH1A1MAPTNPC1HPGD
SCHEMBL5383817 0.83 IRAK4 (0.41) AURKAIRAK4CDC7PLK4CHEK1
SCHEMBL5374602 0.79 NPC1 (0.43) MAPK1ALDH1A1MAPTNPC1HPGD
SCHEMBL5378533 0.79 IRAK4 (0.38) AURKAIRAK4CDC7PLK4CHEK1
SCHEMBL5366157 0.77 NPC1 (0.45) CDC7MARK3MAPK1STK3ALDH1A1
SCHEMBL5374992 0.74 PDE10A (0.40) AURKAIRAK4CDC7PLK4CHEK1
SCHEMBL5374987 0.74 AR (0.36) AURKAIRAK4CDC7PLK4CHEK1
SCHEMBL5365916 0.74 NOTUM (0.38) JAK2JAK3ALDH1A1MAPTNPC1
SCHEMBL6398487 0.73 NOTUM (0.59) ALDH1A1NOTUMPHGDHLMNAL3MBTL1
SCHEMBL17392707 0.73 NOTUM (0.59) ALDH1A1NOTUMPHGDHLMNAL3MBTL1

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-7238212-B2 Imidazole compounds and use of these compounds for dyeing keratinous fibers L'OREAL, S.A. (FR) 2007-07-03 US claimed
US-20050011019-A1 Novel imidazole compounds and use of these compounds for dyeing keratinous fibers L'OREAL, S.A. (FR) 2005-01-20 US claimed
EP-1484049-A1 Imidazole compounds and their use for dyeing of keratinous fibres L'OREAL (FR) 2004-12-08 EP claimed
US-7238212-B2 Imidazole compounds and use of these compounds for dyeing keratinous fibers L'OREAL, S.A. (FR) 2007-07-03 US disclosed
US-20050011019-A1 Novel imidazole compounds and use of these compounds for dyeing keratinous fibers L'OREAL, S.A. (FR) 2005-01-20 US disclosed
EP-1484049-A1 Imidazole compounds and their use for dyeing of keratinous fibres L'OREAL (FR) 2004-12-08 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-20050011019-A1 Novel imidazole compounds and use of these compounds for dyeing keratinous fibers KRT18, VIM, NDUFS6 AURKA 1343/4885IRAK4 2412/4885CDC7 1866/4885

“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.