SCHEMBL5366157

SCHEMBL5366157

c1ccc(-c2ncc(N3CCCCC3)n2-c2ccccc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 7/20 0.45
RAB9A P51151 7/20 0.45
ALDH1A1 P00352 5/20 0.45
SMN1; SMN2 Q16637 4/20 0.45
MAPT P10636 3/20 0.45
HPGD P15428 2/20 0.45
TSHR P16473 2/20 0.44
RECQL P46063 1/20 0.44
MAPK1 P28482 3/20 0.43
NPSR1 Q6W5P4 1/20 0.43
HTT P42858 3/20 0.42
KDM4E B2RXH2 3/20 0.42
LMNA P02545 3/20 0.42
HSD17B10 Q99714 2/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
TP53 P04637 1/20 0.42
CASP1 P29466 1/20 0.42
CASP3 P42574 1/20 0.42

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
SCHEMBL5374602 0.98 NPC1 (0.43) NPC1RAB9AALDH1A1SMN1; SMN2MAPT
SCHEMBL5365790 0.83 GAA (0.44) NPC1RAB9AALDH1A1SMN1; SMN2MAPT
SCHEMBL5365800 0.81 NPC1 (0.42) NPC1RAB9AALDH1A1SMN1; SMN2MAPT
SCHEMBL5375032 0.79 HPGDS (0.46) NPC1RAB9AALDH1A1SMN1; SMN2MAPT
SCHEMBL5378550 0.78 HPGDS (0.47) NPC1RAB9AALDH1A1SMN1; SMN2MAPT
SCHEMBL5374769 0.77 AURKA (0.40) NPC1RAB9AALDH1A1SMN1; SMN2MAPT
SCHEMBL5371605 0.74 ALDH1A1 (0.41) NPC1RAB9AALDH1A1SMN1; SMN2MAPT
SCHEMBL5367538 0.73 ALDH1A1 (0.40) NPC1RAB9AALDH1A1SMN1; SMN2MAPT
SCHEMBL5365956 0.71 ALDH1A1 (0.40) ALDH1A1MAPTHPGDTSHRMAPK1
SCHEMBL11978680 0.71 MEN1 (0.50) ALDH1A1SMN1; SMN2MAPTHPGDTSHR

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 NPC1 4789/4885RAB9A 3755/4885ALDH1A1 415/4885

“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.