SCHEMBL5376007

SCHEMBL5376007

OCCn1cncc1N1CCCCC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
CYP3A4 P08684 3/20 0.41
CYP2C9 P11712 2/20 0.41
CYP2C19 P33261 2/20 0.41
ROCK2 O75116 1/20 0.35
ROCK1 Q13464 1/20 0.35
ALDH1A1 P00352 2/20 0.34
GAA P10253 2/20 0.32
MAPT P10636 2/20 0.31
NPC1 O15118 1/20 0.31
AVPR1A P37288 1/20 0.31
RAB9A P51151 1/20 0.31
SLC29A1 Q99808 8/20 0.31
TDO2 P48775 1/20 0.31
KDM4E B2RXH2 1/20 0.31
PDE2A O00408 1/20 0.31
RGS12 O14924 1/20 0.31
SLC22A2 O15244 1/20 0.31
SLC22A1 O15245 1/20 0.31

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
SCHEMBL5374725 0.98 CYP3A4 (0.39) MEN1KMT2ACYP3A4CYP2C9CYP2C19
SCHEMBL5369126 0.76 CNR2 (0.36) PDE10A
SCHEMBL5366108 0.72 ALDH1A1 (0.39) MEN1KMT2AROCK2ROCK1ALDH1A1
SCHEMBL5374526 0.70 ALDH1A1 (0.36) MEN1KMT2AALDH1A1GAAMAPT
SCHEMBL5371084 0.68 MEN1 (0.40) MEN1KMT2ACYP3A4CYP2C9CYP2C19
SCHEMBL5371588 0.67 KMT2A (0.42) MEN1KMT2ACYP3A4CYP2C9CYP2C19
SCHEMBL5371582 0.67 ALDH1A1 (0.49) MEN1KMT2ACYP3A4CYP2C9CYP2C19
SCHEMBL5371086 0.67 ALDH1A1 (0.39) MEN1KMT2ACYP3A4CYP2C9CYP2C19
SCHEMBL5369228 0.66
SCHEMBL3276126 0.66

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 MEN1 3936/4885KMT2A 1256/4885CYP3A4 1364/4885

“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.