SCHEMBL5372890

SCHEMBL5372890

Cc1nc(N2CCC(O)C2)cn1CCO

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 11/20 0.37
PDE10A Q9Y233 2/20 0.36
IKBKB O14920 2/20 0.36
PRKDC P78527 1/20 0.34
PIM1 P11309 2/20 0.33
PIM3 Q86V86 2/20 0.33
PIM2 Q9P1W9 2/20 0.33
CDK4 P11802 1/20 0.33
CDK6 Q00534 1/20 0.33
METAP2 P50579 1/20 0.33

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
SCHEMBL5373084 0.81 PDE10A (0.37) CNR2PDE10AIKBKBPRKDCPIM1
SCHEMBL5378536 0.81 PRKDC (0.38) CNR2PDE10APRKDCPIM1
SCHEMBL5368018 0.79 KMT2A (0.40) PDE10A
SCHEMBL5371588 0.78 KMT2A (0.42)
SCHEMBL5378310 0.72 PRKDC (0.41) PDE10APRKDCMETAP2
SCHEMBL5369131 0.71 CNR2 (0.36) CNR2PDE10APRKDCPIM1PIM3
SCHEMBL5369126 0.71 CNR2 (0.36) CNR2PDE10ACDK4CDK6
SCHEMBL5372887 0.69 ALDH1A1 (0.43) CNR2PDE10ACDK4CDK6
SCHEMBL5383820 0.69 IRAK1 (0.41) CNR2PDE10APRKDCPIM1PIM3
SCHEMBL5371109 0.69 CNR2 (0.36) CNR2

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 CNR2 3874/4885PDE10A 3476/4885IKBKB 1683/4885

“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.