SCHEMBL5378564

SCHEMBL5378564

Cc1ncc(N2CCCC2)n1C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
LRRK2 Q5S007 1/20 0.36
GSK3B P49841 2/20 0.34
SMN1; SMN2 Q16637 3/20 0.33
PDE10A Q9Y233 2/20 0.33
POLB P06746 1/20 0.33
NUDT1 P36639 1/20 0.33
HTT P42858 2/20 0.33
SMPD3 Q9NY59 1/20 0.33
GAA P10253 3/20 0.32
KDM4E B2RXH2 3/20 0.32
HPGD P15428 2/20 0.32
HSD17B10 Q99714 2/20 0.32
GLA P06280 1/20 0.32
TSHR P16473 1/20 0.32
RECQL P46063 1/20 0.32
MAPT P10636 2/20 0.32
THRB P10828 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
SCHEMBL5387392 0.98 ALDH1A1 (0.42) ALDH1A1MEN1KMT2ALRRK2GSK3B
SCHEMBL3498748 0.78 ALDH1A1 (0.38) ALDH1A1MEN1KMT2ALRRK2GSK3B
SCHEMBL5368015 0.74 ALDH1A1 (0.50) ALDH1A1MEN1KMT2ASMN1; SMN2PDE10A
SCHEMBL5378550 0.74 HPGDS (0.47) ALDH1A1MEN1KMT2ASMN1; SMN2HTT
SCHEMBL5373081 0.73 PDE10A (0.37) PDE10AMAPTCNR2
SCHEMBL5371582 0.73 ALDH1A1 (0.49) ALDH1A1MEN1KMT2ASMN1; SMN2PDE10A
SCHEMBL5375032 0.73 HPGDS (0.46) ALDH1A1MEN1KMT2ASMN1; SMN2HTT
SCHEMBL5365800 0.71 NPC1 (0.42) ALDH1A1MEN1KMT2ASMN1; SMN2HTT
SCHEMBL5365790 0.70 GAA (0.44) ALDH1A1MEN1KMT2ASMN1; SMN2HTT
SCHEMBL14980164 0.69

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 415/4885MEN1 3936/4885KMT2A 1256/4885

“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.