SCHEMBL5387401

SCHEMBL5387401

OCCNc1ncn(-c2ccccc2)c1Cl

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
HTT P42858 2/20 0.44
MAPK1 P28482 2/20 0.44
KDM4E B2RXH2 2/20 0.44
MKNK1 Q9BUB5 2/20 0.42
MKNK2 Q9HBH9 2/20 0.42
POLB P06746 2/20 0.40
PKM P14618 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
RAD52 P43351 2/20 0.39
LMNA P02545 3/20 0.38
FGFR1 P11362 2/20 0.38
MITF O75030 1/20 0.37
ALDH1A1 P00352 1/20 0.37
TTR P02766 1/20 0.37
GLA P06280 1/20 0.37

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
SCHEMBL5387397 0.79 MKNK1 (0.42) TSHRCYP2D6CYP2C9CYP2C19HTT
SCHEMBL5369278 0.76 FGFR1 (0.42) TSHRCYP2D6CYP2C9CYP2C19HTT
SCHEMBL5375075 0.72 CDK1 (0.43) TSHRCYP2D6CYP2C9HTTMAPK1
SCHEMBL5371753 0.71 HTT (0.42) CYP2D6CYP2C19HTTMAPK1KDM4E
SCHEMBL5366186 0.71 TSHR (0.48) TSHRCYP2C19HTTMAPK1KDM4E
SCHEMBL5374635 0.70 TSHR (0.47) TSHRMAPK1KDM4EPOLBRAD52
SCHEMBL31122989 0.69 MKNK1 (0.66) HTTMKNK1MKNK2POLBFGFR1
SCHEMBL5369097 0.69 TSHR (0.42) TSHRHTTMAPK1KDM4EMKNK1
SCHEMBL5372900 0.68 ALDH1A1 (0.47) MAPK1KDM4EMEN1KMT2ARAD52
SCHEMBL5371152 0.66 MKNK1 (0.52) HTTMKNK1MKNK2FGFR1SRC

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 TSHR 4859/4885CYP2D6 2109/4885CYP2C9 1818/4885

“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.