SCHEMBL4653523

SCHEMBL4653523

NCCCCCCCCCCCC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)O

nearest known ligand 0.69

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ SLC6A5 Q9Y345 1/20 0.69
▸ SLC15A2 Q16348 1/20 0.67
▸ EPHX2 P34913 1/20 0.58
▸ CPB2 Q96IY4 2/20 0.56
▸ ITGB2 P05107 3/20 0.55
▸ ICAM1 P05362 3/20 0.55
▸ ITGAL P20701 3/20 0.55
▸ CA1 P00915 3/20 0.52
▸ CA2 P00918 3/20 0.52
▸ CYP3A4 P08684 1/20 0.50
▸ SLC7A5 Q01650 1/20 0.50
▸ FAAH O00519 1/20 0.48
▸ CNR1 P21554 1/20 0.48
▸ CNR2 P34972 1/20 0.48
▸ ITGB3 P05106 1/20 0.47
▸ ITGA2B P08514 1/20 0.47
▸ HRH4 Q9H3N8 1/20 0.47
▸ HRH3 Q9Y5N1 1/20 0.47
▸ HRH1 P35367 2/20 0.47

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
SCHEMBL7887542 1.00 SLC6A5 (0.69) SLC6A5SLC15A2EPHX2CPB2ITGB2
SCHEMBL7257727 0.99 SLC15A2 (0.69) SLC6A5SLC15A2EPHX2CPB2ITGB2
SCHEMBL26126281 0.95 SLC15A2 (0.67) SLC6A5SLC15A2EPHX2CPB2ITGB2
SCHEMBL541262 0.95 SLC15A2 (0.67) SLC6A5SLC15A2EPHX2CPB2ITGB2
SCHEMBL21631681 0.95 SLC15A2 (0.67) SLC6A5SLC15A2EPHX2CPB2ITGB2
Carnosine SCHEMBL22191128 0.94 SLC15A2 (0.69) SLC6A5SLC15A2EPHX2CPB2ITGB2
SCHEMBL18857761 0.90 SLC15A2 (0.58) SLC6A5SLC15A2EPHX2CPB2HRH4
Carnosine SCHEMBL22392772 0.90 SLC15A2 (0.63) SLC6A5SLC15A2EPHX2CPB2ITGB2
Carnosine SCHEMBL1160796 0.90 SLC15A2 (0.63) SLC6A5SLC15A2EPHX2CPB2ITGB2
Carnosine SCHEMBL1161102 0.90 SLC15A2 (0.63) SLC6A5SLC15A2EPHX2CPB2ITGB2

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 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0972511-B1 Association of a retinoid with a histidine derivative OREAL (FR) 2003-04-09 — — EP claimed
US-6358514-B1 FOR SKIN AND HAIRCARE L'OREAL (FR) 2002-03-19 — — US claimed
EP-0972511-A1 Association of a retinoid with a histidine derivative L'OREAL (FR) 2000-01-19 — — EP claimed
WO-1999047504-A1 NOVEL HISTIDINE DERIVATIVES PREPARATION METHOD AND USES L'OREAL (FR) 1999-09-23 — — WO claimed
EP-1602354-B1 Use of polyglutamic acid or its salts MEIJI SEIKA KAISHA (JP) 2008-11-05 — — EP disclosed
EP-1604647-B1 Cosmetic composition containing polyorganosiloxane-containing epsilon-polylysine polymer, and polyhydric alcohol, and production thereof CHISSO CORP (JP) 2008-05-07 — — EP disclosed
US-20060165636-A1 Hair treatment composition and hair cosmetic for damaged hair MEIJI SEIKA KAISHA, LTD. (JP) 2006-07-27 — — US disclosed
US-20060018867-A1 Cosmetic composition and production thereof ICHIMARU PHARCOS CO., LTD 2006-01-26 — — US disclosed
EP-1604647-A1 Cosmetic composition containing polyorganosiloxane-containing epsilon-polylysine polymer, and polyhydric alcohol, and production thereof Ichimaru Pharcos Co., Ltd. (JP) 2005-12-14 — — EP disclosed
EP-1602354-A1 HAIR TREATMENT COMPOSITION AND HAIR COSMETIC FOR DAMAGED HAIR Meiji Seika Kaisha, Ltd. (JP) 2005-12-07 — — EP disclosed
EP-0972511-B1 Association of a retinoid with a histidine derivative OREAL (FR) 2003-04-09 — — EP disclosed
US-6358514-B1 FOR SKIN AND HAIRCARE L'OREAL (FR) 2002-03-19 — — US disclosed
EP-0972511-A1 Association of a retinoid with a histidine derivative L'OREAL (FR) 2000-01-19 — — EP disclosed
WO-1999047504-A1 NOVEL HISTIDINE DERIVATIVES PREPARATION METHOD AND USES L'OREAL (FR) 1999-09-23 — — WO 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 (2 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-20060165636-A1 Hair treatment composition and hair cosmetic for damaged hair CUTA, COL14A1, PRKDC SLC6A5 1664/4885SLC15A2 819/4885EPHX2 4734/4885
US-20060018867-A1 Cosmetic composition and production thereof CUTA, PARG, TYR SLC6A5 3000/4885SLC15A2 4199/4885EPHX2 2379/4885

“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.

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