SCHEMBL5387375

SCHEMBL5387375

Cn1c(-c2ccccc2)nc(N2CCCC2)c1Cl

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 9/20 0.48
CYP1A2 P05177 1/20 0.45
KDM4E B2RXH2 3/20 0.45
ALDH1A1 P00352 3/20 0.45
ADORA2A P29274 2/20 0.45
ADRA2A P08913 1/20 0.45
HPGD P15428 1/20 0.45
RXFP1 Q9HBX9 1/20 0.45
ACP1 P24666 2/20 0.44
TDP1 Q9NUW8 2/20 0.43
KMT2A Q03164 2/20 0.43
MAPT P10636 1/20 0.43
TSHR P16473 1/20 0.43
MAPK1 P28482 1/20 0.43
CASP1 P29466 1/20 0.43
CASP7 P55210 1/20 0.43
GFER P55789 1/20 0.43
HSD17B10 Q99714 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
MEN1 O00255 1/20 0.43

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
SCHEMBL5369275 0.98 NPY5R (0.50) NPY5RCYP1A2KDM4EALDH1A1ADORA2A
SCHEMBL5365961 0.80 KDM4E (0.44) NPY5RCYP1A2KDM4EALDH1A1ADORA2A
SCHEMBL5371637 0.79 IRAK4 (0.42) NPY5RMAPK1
SCHEMBL5367541 0.79 ADORA2A (0.45) NPY5RKDM4EALDH1A1ADORA2AADRA2A
SCHEMBL5371936 0.79 ALDH1A1 (0.42) NPY5RKDM4EALDH1A1ADORA2AADRA2A
SCHEMBL5387371 0.78 KMT2A (0.43) NPY5RCYP1A2KDM4EADORA2AHPGD
SCHEMBL5365982 0.77 ALDH1A1 (0.42) NPY5RKDM4EALDH1A1ADORA2AADRA2A
SCHEMBL5369270 0.77 NPY5R (0.44) NPY5RKDM4EALDH1A1ADORA2AHPGD
SCHEMBL5369664 0.74 PDE10A (0.41) CYP1A2KDM4EALDH1A1TDP1MAPT
SCHEMBL5375112 0.73 PDE10A (0.42) CYP1A2ALDH1A1KMT2ATSHRGFER

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 NPY5R 3942/4885CYP1A2 1784/4885KDM4E 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.