SCHEMBL5374628

SCHEMBL5374628

OCCNc1c(Cl)nc(-c2ccccc2)n1-c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.48
ALDH1A1 P00352 5/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
KDM4E B2RXH2 5/20 0.40
HPGD P15428 3/20 0.40
GLA P06280 2/20 0.40
GAA P10253 2/20 0.40
MAPK1 P28482 3/20 0.39
RAB9A P51151 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
RAD52 P43351 1/20 0.39
MDM2 Q00987 1/20 0.39
ADORA1 P30542 1/20 0.38
RECQL P46063 1/20 0.38
MCL1 Q07820 1/20 0.38
HSD17B10 Q99714 2/20 0.38

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
SCHEMBL5366183 0.86 TSHR (0.48) TSHRALDH1A1KDM4EHPGDGLA
SCHEMBL5372896 0.83 KDM4E (0.42) ALDH1A1SMN1; SMN2L3MBTL1KDM4EHPGD
SCHEMBL5387421 0.82 ALDH1A1 (0.44) ALDH1A1SMN1; SMN2L3MBTL1KDM4EHPGD
SCHEMBL5374635 0.82 TSHR (0.47) TSHRALDH1A1SMN1; SMN2L3MBTL1KDM4E
SCHEMBL5366123 0.77 AVPR1A (0.44) TSHRALDH1A1SMN1; SMN2KDM4EHPGD
SCHEMBL5383913 0.72 TSHR (0.46) TSHRALDH1A1SMN1; SMN2KDM4EHPGD
SCHEMBL5366186 0.71 TSHR (0.48) TSHRALDH1A1KDM4EHPGDGLA
SCHEMBL5387397 0.71 MKNK1 (0.42) TSHRALDH1A1KDM4EGLAGAA
SCHEMBL8027129 0.71 TSHR (0.47) TSHRALDH1A1SMN1; SMN2L3MBTL1KDM4E
SCHEMBL5367542 0.70 PI4KA (0.49) TSHRALDH1A1SMN1; SMN2KDM4EHPGD

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 4859/4885ALDH1A1 415/4885SMN1; SMN2 4554/4885

“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.