SCHEMBL5378536

SCHEMBL5378536

OCCn1cc(N2CCC(O)C2)nc1-c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKDC P78527 1/20 0.38
P2RX7 Q99572 1/20 0.38
PDE10A Q9Y233 1/20 0.37
CNR2 P34972 1/20 0.37
IRAK4 Q9NWZ3 2/20 0.36
IRAK1 P51617 1/20 0.36
NAPEPLD Q6IQ20 7/20 0.36
P2RY12 Q9H244 2/20 0.36
CDC7 O00311 1/20 0.36
PLK4 O00444 1/20 0.36
CHEK1 O14757 1/20 0.36
AURKA O14965 1/20 0.36
PDPK1 O15530 1/20 0.36
JAK2 O60674 1/20 0.36
ROCK2 O75116 1/20 0.36
PAK4 O96013 1/20 0.36
CHEK2 O96017 1/20 0.36
EGFR P00533 1/20 0.36
NTRK1 P04629 1/20 0.36
PRKCG P05129 1/20 0.36

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
SCHEMBL5383820 0.82 IRAK1 (0.41) PRKDCPDE10ACNR2IRAK4IRAK1
SCHEMBL5375108 0.82 KMT2A (0.43) PDE10AKMT2A
SCHEMBL5371609 0.81 HPGD (0.43) PDE10AMAPK1MEN1KMT2A
SCHEMBL5372890 0.81 CNR2 (0.37) PRKDCPDE10ACNR2PIM1
SCHEMBL5374776 0.80 GABRA2 (0.40) PRKDCP2RY12NPY5R
SCHEMBL5369627 0.74 MAPK1 (0.37) P2RX7IRAK4CDC7PLK4CHEK1
SCHEMBL5369630 0.74 CNR2 (0.38) PDE10ACNR2IRAK4IRAK1CDC7
SCHEMBL5378533 0.73 IRAK4 (0.38) CNR2IRAK4IRAK1CDC7PLK4
SCHEMBL5378310 0.70 PRKDC (0.41) PRKDCP2RX7PDE10ANAPEPLDP2RY12
SCHEMBL5366217 0.68 TLR8 (0.38) LCKGSK3BKMT2A

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 PRKDC 54/4885P2RX7 4045/4885PDE10A 3476/4885

“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.