SCHEMBL5366186

SCHEMBL5366186

Cc1nc(NCCO)c(Cl)n1-c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.48
MAPK1 P28482 3/20 0.45
KDM4E B2RXH2 3/20 0.45
CNR2 P34972 1/20 0.41
KMT2A Q03164 3/20 0.40
TAAR1 Q96RJ0 1/20 0.40
RAD52 P43351 2/20 0.40
PGK1 P00558 1/20 0.40
HTT P42858 1/20 0.40
RAB9A P51151 2/20 0.39
MEN1 O00255 1/20 0.39
NPC1 O15118 1/20 0.39
CYP2C19 P33261 1/20 0.39
ALDH1A1 P00352 2/20 0.39
GLA P06280 2/20 0.39
GAA P10253 2/20 0.39
MITF O75030 1/20 0.39
LMNA P02545 1/20 0.39
TTR P02766 1/20 0.39
POLB P06746 1/20 0.39

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
SCHEMBL5374635 0.84 TSHR (0.47) TSHRMAPK1KDM4ERAD52RAB9A
SCHEMBL5366183 0.80 TSHR (0.48) TSHRMAPK1KDM4ECNR2RAD52
SCHEMBL5366008 0.79 MAPK1 (0.46) TSHRMAPK1CNR2KMT2AHTT
SCHEMBL5372900 0.74 ALDH1A1 (0.47) MAPK1KDM4EKMT2ATAAR1RAD52
SCHEMBL5371164 0.73 KDM4E (0.38) MAPK1KDM4EKMT2ATAAR1HTT
SCHEMBL5374628 0.71 TSHR (0.48) TSHRMAPK1KDM4ERAD52HTT
SCHEMBL19365959 0.71 MAPK1 (0.52) TSHRMAPK1CNR2KMT2AHTT
SCHEMBL5383832 0.71 KMT2A (0.41) MAPK1KDM4EKMT2AHTTRAB9A
SCHEMBL5387401 0.71 TSHR (0.45) TSHRMAPK1KDM4EKMT2ARAD52
SCHEMBL5378807 0.71 TSHR (0.47) TSHRMAPK1KDM4EKMT2ARAD52

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 4859/4885MAPK1 2658/4885KDM4E 452/4885

“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.