SCHEMBL5374776

SCHEMBL5374776

OC1CCN(c2cn(-c3ccccc3)c(-c3ccccc3)n2)C1

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GABRA2 P47869 1/20 0.40
GABRB2 P47870 1/20 0.40
PRKDC P78527 1/20 0.40
CNR1 P21554 1/20 0.38
NPY5R Q15761 1/20 0.38
P2RY12 Q9H244 1/20 0.38

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
SCHEMBL5378310 0.85 PRKDC (0.41) PRKDCP2RY12
SCHEMBL5383820 0.84 IRAK1 (0.41) PRKDCNPY5RP2RY12
SCHEMBL5378536 0.80 PRKDC (0.38) PRKDCNPY5RP2RY12
SCHEMBL5374606 0.78 KMT2A (0.49) GABRA2GABRB2
SCHEMBL5366159 0.77 HPGD (0.49)
SCHEMBL3436548 0.74 NOTUM (0.59)
SCHEMBL6398487 0.74 NOTUM (0.59)
SCHEMBL17392707 0.74 NOTUM (0.59)
SCHEMBL5371637 0.74 IRAK4 (0.42) NPY5R
SCHEMBL5371632 0.74 NPY5R (0.39) NPY5R

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 GABRA2 3663/4885GABRB2 2763/4885PRKDC 54/4885

“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.