SCHEMBL45656

SCHEMBL45656

CCCCCN[C@@H](CCC(=O)O)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOD1 Q9Y239 2/20 0.58
ITGB3 P05106 1/20 0.49
ITGA2B P08514 1/20 0.49
FOLH1 Q04609 2/20 0.49
RIMKLA Q8IXN7 1/20 0.48
NAALAD2 Q9Y3Q0 1/20 0.48
AKR1B1 P15121 1/20 0.47
GGH Q92820 1/20 0.46
GPR84 Q9NQS5 7/20 0.45
PPARG P37231 6/20 0.45
PPARD Q03181 6/20 0.45
PPARA Q07869 6/20 0.45
HDAC11 Q96DB2 5/20 0.45
TSHR P16473 4/20 0.45
ALDH1A1 P00352 2/20 0.45
TLR2 O60603 2/20 0.45
TDP1 Q9NUW8 2/20 0.45
FABP4 P15090 2/20 0.45
PTPN1 P18031 2/20 0.45
PLA2G10 O15496 1/20 0.45

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
SCHEMBL1325387 1.00 NOD1 (0.58) NOD1ITGB3ITGA2BFOLH1RIMKLA
SCHEMBL45655 1.00 NOD1 (0.58) NOD1ITGB3ITGA2BFOLH1RIMKLA
SCHEMBL2721132 0.98 NOD1 (0.60) NOD1ITGB3ITGA2BFOLH1GPR84
SCHEMBL8383009 0.98 NOD1 (0.60) NOD1ITGB3ITGA2BFOLH1GPR84
SCHEMBL438052 0.98 NOD1 (0.57) NOD1ITGB3ITGA2BFOLH1RIMKLA
SCHEMBL25244619 0.98 NOD1 (0.60) NOD1ITGB3ITGA2BFOLH1GPR84
SCHEMBL1230703 0.98 NOD1 (0.57) NOD1ITGB3ITGA2BFOLH1RIMKLA
SCHEMBL8383011 0.98 NOD1 (0.60) NOD1ITGB3ITGA2BFOLH1GPR84
SCHEMBL2721131 0.98 NOD1 (0.60) NOD1ITGB3ITGA2BFOLH1GPR84
SCHEMBL9940086 0.98 NOD1 (0.57) NOD1ITGB3ITGA2BFOLH1RIMKLA

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

Appears in 5421 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024142846-A1 COSMETIC COMPOSITION 株式会社 資生堂 2024-07-04 WO claimed
CN-118284398-A Cleaning agent composition 味之素株式会社 2024-07-02 CN claimed
US-20240197598-A1 AMINO ACID SCALP AND HAIR CARE COMPOSITION, SCALP AND HAIR CARE PRODUCT CONTAINING SAID COMPOSITION AND PREPARATION METHOD Nanjing Huashi New Material Co., Ltd. (CN) 2024-06-20 US claimed
CN-115590778-B Amino acid scalp hair care composition, scalp hair care product containing composition and preparation method 南京华狮新材料有限公司 2024-06-11 CN claimed
US-20240173226-A1 Oral Care Compositions COLGATE-PALMOLIVE COMPANY (US) 2024-05-30 US claimed
WO-2024112780-A1 ORAL CARE COMPOSITIONS COLGATE-PALMOLIVE COMPANY (US) 2024-05-30 WO claimed
WO-2024112627-A1 ORAL CARE COMPOSITIONS COLGATE-PALMOLIVE COMPANY (US) 2024-05-30 WO claimed
WO-2024112722-A1 ORAL CARE COMPOSITIONS COLGATE-PALMOLIVE COMPANY (US) 2024-05-30 WO claimed
EP-4364721-A1 AMINO ACID SCALP AND HAIR CARE COMPOSITION, SCALP AND HAIR CARE PRODUCT CONTAINING SAID COMPOSITION AND PREPARATION METHOD Nanjing Huashi New Material Co., Ltd. (CN) 2024-05-08 EP claimed
EP-3829528-B1 ENHANCED MOISTURIZER DEPOSITION IN CLEANSING LIQUIDS CONTAINING HYDROPHOBICALLY OR NON-HYDROPHOBICALLY MODIFIED ANIONIC POLYMERS UNILEVER GLOBAL IP LTD (GB) 2024-03-20 EP claimed
EP-0394470-A1 COMPOSITION FOR ORAL CAVITY SUNSTAR KABUSHIKI KAISHA (JP) 1990-10-31 EP claimed
EP-0364928-A2 Paste-like dentifrice composition AJINOMOTO CO., INC. (JP) 1990-04-25 EP claimed
EP-0194097-B1 MILD CLEANSING MOUSSE THE PROCTER & GAMBLE COMPANY (US) 1990-04-25 EP claimed
US-4919846-A Conditioning low skin sensitivity SHISEIDO COMPANY LTD. (JP) 1990-04-24 US claimed
EP-0324575-A2 Detergent composition Kao Corporation (JP) 1989-07-19 EP claimed
US-4842846-A APPLYING TO MOUTH TISSUES; REMOVING HYDROGEN PEROXIDE WITH CATALASE NAKANO MINORU (JP) 1989-06-27 US claimed
EP-0273579-A2 A composition for periodontal use Nakano, Minoru (JP) 1988-07-06 EP claimed
EP-0247832-A1 Detergent compositions SHISEIDO COMPANY LIMITED (JP) 1987-12-02 EP claimed
EP-0062352-B1 SOAP COMPOSITION MITSUBISHI KASEI CORPORATION (JP) 1986-07-30 EP claimed
EP-0062352-A1 Soap composition MITSUBISHI KASEI CORPORATION (JP) 1982-10-13 EP claimed