SCHEMBL5200201

SCHEMBL5200201

CCCCCCCCCCCC(=O)NC(Cc1ccccc1)C(N)=O

nearest known ligand 0.78

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FAAH O00519 2/20 0.67
PSMB5 P28074 2/20 0.61
PTPN1 P18031 1/20 0.59
HDAC3 O15379 1/20 0.57
HDAC4 P56524 1/20 0.57
HDAC1 Q13547 1/20 0.57
HDAC7 Q8WUI4 1/20 0.57
HDAC2 Q92769 1/20 0.57
HDAC10 Q969S8 1/20 0.57
HDAC11 Q96DB2 1/20 0.57
HDAC8 Q9BY41 1/20 0.57
HDAC6 Q9UBN7 1/20 0.57
HDAC9 Q9UKV0 1/20 0.57
HDAC5 Q9UQL6 1/20 0.57
ITGB3 P05106 1/20 0.57
ITGA2B P08514 1/20 0.57
EPHX2 P34913 1/20 0.56

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
SCHEMBL9664715 1.00 FAAH (0.67) FAAHPSMB5PTPN1HDAC3HDAC4
SCHEMBL5200203 1.00 FAAH (0.67) FAAHPSMB5PTPN1HDAC3HDAC4
SCHEMBL9666046 1.00 FAAH (0.67) FAAHPSMB5PTPN1HDAC3HDAC4
SCHEMBL9664236 1.00 FAAH (0.67) FAAHPSMB5PTPN1HDAC3HDAC4
SCHEMBL9666189 1.00 FAAH (0.67) FAAHPSMB5PTPN1HDAC3HDAC4
SCHEMBL9666396 0.99 FAAH (0.65) FAAHPSMB5PTPN1HDAC3HDAC4
SCHEMBL3147995 0.94 PSMB5 (0.60) FAAHPSMB5PTPN1HDAC3HDAC4
SCHEMBL23210005 0.93 FAAH (0.76) FAAHPSMB5PTPN1HDAC3HDAC4
SCHEMBL18797414 0.93 FAAH (0.76) FAAHPSMB5PTPN1HDAC3HDAC4
SCHEMBL19650462 0.90 FAAH (0.59) FAAHPSMB5PTPN1HDAC3HDAC4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1304999-B1 ANTIPERSPIRANT FORMULATIONS UNILEVER PLC (GB) 2007-08-15 EP disclosed
US-20070116662-A1 Antiperspirant/deodorant compositions EXXONMOBIL CHEMICAL PATENTS INC. 2007-05-24 US disclosed
WO-2007058735-A1 ANTIPERSPIRANT/DEODORANT COMPOSITIONS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2007-05-24 WO disclosed
EP-1304999-A1 ANTIPERSPIRANT FORMULATIONS UNILEVER PLC (GB) 2003-05-02 EP disclosed
US-20020039563-A1 Antiperspirant formulations UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC 2002-04-04 US disclosed
US-6361766-B1 ANHYDROUS FORMULATION COMPRISING PARTICULATE ANTIPERSPIRANT SUSPENDED IN WATER-IMMISCIBLE CARRIER FLUID COMPRISING OXYGEN-CONTAINING EMOLLIENT OIL HAVING SPECIFIED REFRACTIVE INDEX STRUCTURED BY WAX OR NONPOLYMERIC FIBER-FORMING GELLANT UNILEVER HOME & PERSONAL CARE, USA DIVISION OF CONOPCO, INC. 2002-03-26 US disclosed
US-20020034481-A1 Antiperspirant formulations UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2002-03-21 US disclosed
WO-2002011691-A1 ANTIPERSPIRANT FORMULATIONS UNILEVER PLC (GB) 2002-02-14 WO disclosed
WO-2002011692-A1 ANTIPERSPIRANT FORMULATIONS UNILEVER PLC (GB) 2002-02-14 WO disclosed
US-3969087-A Gels of nonpolar liquids with N-acyl amino acids and derivatives thereof as gelling agents AJINOMOTO CO., LTD. (JA) 1976-07-13 US 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 (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-20020034481-A1 Antiperspirant formulations ADH1A, SOAT1, CUTA FAAH 43/4885PSMB5 3071/4885PTPN1 1606/4885
US-20070116662-A1 Antiperspirant/deodorant compositions PUF60, DDT, DECR1 FAAH 490/4885PSMB5 965/4885PTPN1 2099/4885
US-20020039563-A1 Antiperspirant formulations ADH1A, SOAT1, CUTA FAAH 58/4885PSMB5 3915/4885PTPN1 1219/4885

“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.