SCHEMBL5371683

SCHEMBL5371683

Cc1ncc(NCCO)n1CCO

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.47
MAPK1 P28482 2/20 0.47
LMNA P02545 2/20 0.47
THRB P10828 1/20 0.47
TSHR P16473 1/20 0.47
KMT2A Q03164 4/20 0.36
MEN1 O00255 3/20 0.36
GAA P10253 2/20 0.36
KDM4E B2RXH2 3/20 0.34
HSD17B10 Q99714 3/20 0.34
RAB9A P51151 3/20 0.33
NPC1 O15118 2/20 0.33
CDK1 P06493 1/20 0.33
POLB P06746 2/20 0.33
CA12 O43570 2/20 0.32
CA1 P00915 2/20 0.32
CA2 P00918 2/20 0.32
CA9 Q16790 2/20 0.32
IKBKB O14920 1/20 0.32
CHUK O15111 1/20 0.32

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
SCHEMBL5374152 0.82 KDM4E (0.39) ALDH1A1MAPK1LMNATHRBTSHR
SCHEMBL5371955 0.82 ALDH1A1 (0.50) ALDH1A1MAPK1LMNATHRBTSHR
SCHEMBL5374533 0.76 MAP4K4 (0.41) ALDH1A1MAPK1LMNAKMT2AMEN1
SCHEMBL7455961 0.74 LMNA (0.56) ALDH1A1MAPK1LMNATHRBTSHR
SCHEMBL5378807 0.71 TSHR (0.47) ALDH1A1MAPK1LMNATSHRKMT2A
SCHEMBL5369820 0.71 LMNA (0.53) ALDH1A1MAPK1LMNATHRBTSHR
SCHEMBL5378577 0.68 ALDH1A1 (0.50) ALDH1A1MAPK1LMNATHRBTSHR
SCHEMBL5371120 0.68 HPGDS (0.44) ALDH1A1MAPK1KMT2AMEN1GAA
SCHEMBL28699419 0.67 LMNA (0.49) ALDH1A1MAPK1LMNATHRBTSHR
SCHEMBL11918312 0.67 LMNA (0.53) ALDH1A1MAPK1LMNATHRBTSHR

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 ALDH1A1 415/4885MAPK1 2658/4885LMNA 1593/4885

“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.