SCHEMBL5374602

SCHEMBL5374602

c1ccc(-c2ncc(N3CCCC3)n2-c2ccccc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 7/20 0.43
RAB9A P51151 7/20 0.43
MAPT P10636 3/20 0.43
MAPK1 P28482 2/20 0.43
NPSR1 Q6W5P4 1/20 0.43
SMN1; SMN2 Q16637 5/20 0.43
ALDH1A1 P00352 4/20 0.43
HPGD P15428 3/20 0.43
TSHR P16473 1/20 0.42
RECQL P46063 1/20 0.42
HTT P42858 3/20 0.40
KMT2A Q03164 3/20 0.40
KDM4E B2RXH2 2/20 0.40
MEN1 O00255 2/20 0.40
HSD17B10 Q99714 2/20 0.40
LMNA P02545 1/20 0.40
TP53 P04637 1/20 0.40
CASP1 P29466 1/20 0.40
CASP3 P42574 1/20 0.40
CASP7 P55210 1/20 0.40

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
SCHEMBL5366157 0.98 NPC1 (0.45) NPC1RAB9AMAPTMAPK1NPSR1
SCHEMBL5365800 0.82 NPC1 (0.42) NPC1RAB9AMAPTMAPK1NPSR1
SCHEMBL5365790 0.81 GAA (0.44) NPC1RAB9AMAPTMAPK1NPSR1
SCHEMBL5378550 0.79 HPGDS (0.47) NPC1RAB9AMAPTMAPK1SMN1; SMN2
SCHEMBL5374769 0.79 AURKA (0.40) NPC1RAB9AMAPTMAPK1NPSR1
SCHEMBL5375032 0.77 HPGDS (0.46) NPC1RAB9AMAPTMAPK1SMN1; SMN2
SCHEMBL5365956 0.72 ALDH1A1 (0.40) MAPTMAPK1NPSR1ALDH1A1HPGD
SCHEMBL11978680 0.72 MEN1 (0.50) MAPTMAPK1SMN1; SMN2ALDH1A1HPGD
SCHEMBL5371605 0.72 ALDH1A1 (0.41) NPC1RAB9AMAPTMAPK1NPSR1
SCHEMBL7062228 0.72 AVPR1A (0.50) NPC1RAB9AMAPTSMN1; SMN2ALDH1A1

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 3755/4885MAPT 588/4885

“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.