SCHEMBL322731

SCHEMBL322731

CCCCCCCCCCCCCCCC(=O)NCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCCN)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ SLC6A5 Q9Y345 3/20 0.52
▸ SLC15A2 Q16348 1/20 0.47
▸ ITGB3 P05106 1/20 0.44
▸ ITGA2B P08514 1/20 0.44
▸ NOD1 Q9Y239 4/20 0.42
▸ APLNR P35414 2/20 0.41
▸ TLR2 O60603 3/20 0.41
▸ C5AR1 P21730 1/20 0.39
▸ GRIA1 P42261 1/20 0.39
▸ NMT2 O60551 1/20 0.39
▸ NMT1 P30419 1/20 0.39
▸ NPBWR1 P48145 1/20 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
SCHEMBL1163474 1.00 SLC6A5 (0.52) SLC6A5SLC15A2ITGB3ITGA2BNOD1
SCHEMBL31138844 0.99 SLC6A5 (0.50) SLC6A5SLC15A2ITGB3ITGA2BNOD1
SCHEMBL29467847 0.97 SLC6A5 (0.49) SLC6A5SLC15A2ITGB3ITGA2BNOD1
SCHEMBL17844297 0.90 SLC6A5 (0.52) SLC6A5ITGB3ITGA2BNOD1APLNR
SCHEMBL17844295 0.90 SLC6A5 (0.52) SLC6A5ITGB3ITGA2BNOD1APLNR
SCHEMBL30716920 0.90 SLC6A5 (0.52) SLC6A5SLC15A2ITGB3ITGA2BNOD1
SCHEMBL30562642 0.90 SLC6A5 (0.52) SLC6A5SLC15A2ITGB3ITGA2BNOD1
SCHEMBL29941942 0.90 SLC6A5 (0.52) SLC6A5SLC15A2ITGB3ITGA2BNOD1
SCHEMBL29942005 0.89 SLC6A5 (0.51) SLC6A5SLC15A2ITGB3ITGA2BNOD1
SCHEMBL27605476 0.89 SLC15A2 (0.47) SLC6A5SLC15A2ITGB3ITGA2BTLR2

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 538 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3506873-B1 PERSONAL CARE GEL AND METHOD COLGATE PALMOLIVE CO (US) 2021-11-03 — — EP claimed
EP-3137039-B1 PERSONAL CARE COMPOSITION FOR A KERATIN SUBSTRATE COMPRISING CONDITIONING AND/OR STYLING CATIONIC TETRA POLYMER HERCULES LLC (US) 2020-08-12 — — EP claimed
EP-2914239-B1 COMPOSITION COMPRISING CONDITIONING AND/OR STYLING POLYMER HERCULES LLC (US) 2020-04-29 — — EP claimed
US-10610480-B2 Personal care composition for a keratin substrate comprising conditioning, color protecting and styling polymer ISP INVESTMENTS LLC (US) 2020-04-07 — — US claimed
EP-3522859-A1 PERSONAL CARE COMPOSITION FOR A KERATIN SUBSTRATE COMPRISING CONDITIONING, COLOR PROTECTING AND STYLING POLYMER ISP Investments LLC (US) 2019-08-14 — — EP claimed
US-20190209442-A1 Personal Care Gel and Method COLGATE-PALMOLIVE COMPANY (US) 2019-07-11 — — US claimed
EP-3506873-A1 PERSONAL CARE GEL AND METHOD Colgate-Palmolive Company (US) 2019-07-10 — — EP claimed
US-20190151224-A1 PERSONAL CARE COMPOSITIONS COMPRISING COPOLYMERS OF CATIONIC MONOMERS AND ACRYLOYL LACTAM BASED MONOMERS, PROCESS FOR THE SAME AND METHOD OF USE ISP INVESTMENTS LLC (US) 2019-05-23 — — US claimed
US-20190099349-A1 PERSONAL CARE COMPOSITION FOR A KERATIN SUBSTRATE COMPRISING CONDITIONING, COLOR PROTECTING AND STYLING POLYMER ISP INVESTMENTS LLC (US) 2019-04-04 — — US claimed
WO-2018056989-A1 PERSONAL CARE GEL AND METHOD COLGATE-PALMOLIVE COMPANY (US) 2018-03-29 — — WO claimed
US-7459166-B2 Cosmetic product containing mineral water for remineralizing and rejuvenating the skin COTY B.V. (NL) 2008-12-02 — — US claimed
US-20080213198-A1 Cosmetic or Dermopharmaceutical Composition Comprising at Least one Udp Glucuronosyl Transferase (Ugt) Enzymes Inducer SEDERMA SAS (FR) 2008-09-04 — — US claimed
EP-1904020-A2 NEW SLIMMING COSMETIC COMPOSITIONS Sederma S.A.S. (FR) 2008-04-02 — — EP claimed
EP-1633441-B1 COSMETIC PRODUCT CONTAINING MINERAL WATER FOR REMINERALISING AND REJUVENATING THE SKIN COTY BV (NL) 2008-02-13 — — EP claimed
US-7235249-B2 Methods for regulating the condition of mammalian keratinous tissue via topical application of vitamin B6 compositions THE PROCTER & GAMBLE COMPANY (US) 2007-06-26 — — US claimed
EP-1776161-A1 COSMETIC OR DERMOPHARMACEUTICAL COMPOSITION COMPRISING AT LEAST ONE UDP GLUCURONOSYL TRANSFERASE (UGT) ENZYMES INDUCER Sederma S.A.S. (FR) 2007-04-25 — — EP claimed
US-20070086966-A1 Cosmetic product containing mineral water for remineralising and rejuvenating the skin JPMORGAN CHASE BANK, N.A. 2007-04-19 — — US claimed
WO-2007010478-A2 SLIMMING COSMETIC COMPOSITIONS SEDERMA (FR) 2007-01-25 — — WO claimed
WO-2005102266-A1 COSMETIC OR DERMOPHARMACEUTICAL COMPOSITION COMPRISING AT LEAST ONE UDP GLUCURONOSYL TRANSFERASE (UGT) ENZYMES INDUCER SEDERMA, SAS (FR) 2005-11-03 — — WO claimed
US-6492326-B1 CONTAINING A PENTAPEPTIDE THE PROCTER & GAMBLE COMPANY 2002-12-10 — — US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 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-20080213198-A1 Cosmetic or Dermopharmaceutical Composition Comprising at Least one Udp Glucuronosyl Transferase (Ugt) Enzymes Inducer UGT1A1, UGT1A3, UGDH SLC6A5 4076/4885SLC15A2 762/4885ITGB3 3287/4885
US-20190209442-A1 Personal Care Gel and Method CUTA, GLMN, ISG15 SLC6A5 3266/4885SLC15A2 1425/4885ITGB3 2628/4885
US-20190151224-A1 PERSONAL CARE COMPOSITIONS COMPRISING COPOLYMERS OF CATIONIC MONOMERS AND ACRYLOYL LACTAM BASED MONOMERS, PROCESS FOR THE SAME AND METHOD OF USE AADAC, KRT18, AAAS SLC6A5 3057/4885SLC15A2 3381/4885ITGB3 732/4885

“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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