SCHEMBL3935320

SCHEMBL3935320

CCCCCCC(C)[C](C)O

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.52
ACE2 Q9BYF1 1/20 0.52
FFAR1 O14842 2/20 0.47
FFAR4 Q5NUL3 1/20 0.47
GPR84 Q9NQS5 5/20 0.46
FDPS P14324 3/20 0.46
SPHK1 Q9NYA1 1/20 0.46
LMNA P02545 1/20 0.46
MAPT P10636 1/20 0.45
LCK P06239 1/20 0.45
PPARD Q03181 1/20 0.45
ZDHHC20 Q5W0Z9 1/20 0.45
ZDHHC2 Q9UIJ5 1/20 0.45
OPRM1 P35372 1/20 0.44

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
SCHEMBL3942651 1.00 CA1 (0.52) CA1ACE2FFAR1FFAR4GPR84
SCHEMBL3946026 0.97 CA1 (0.54) CA1ACE2FFAR1FFAR4GPR84
SCHEMBL3940035 0.90
SCHEMBL10942476 0.82 CA1 (0.54) CA1ACE2FFAR1FFAR4GPR84
SCHEMBL20520253 0.82 CA1 (0.54) CA1ACE2FFAR1FFAR4GPR84
SCHEMBL2301401 0.82 CA1 (0.54) CA1ACE2FFAR1FFAR4GPR84
SCHEMBL20520255 0.82 CA1 (0.54) CA1ACE2FFAR1FFAR4GPR84
SCHEMBL20520239 0.82 CA1 (0.54) CA1ACE2FFAR1FFAR4GPR84
SCHEMBL1279390 0.82 CA1 (0.54) CA1ACE2FFAR1FFAR4GPR84
SCHEMBL502907 0.82 CA1 (0.54) CA1ACE2FFAR1FFAR4GPR84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4710491-A N-glycosylated carboxylic acid derivatives as agents for combating rheumatic diseases TROPONWERKE GMBH & CO., KG (DE) 1987-12-01 US claimed
EP-2046147-B1 METHOD OF USING ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2013-05-01 EP disclosed
US-20090311403-A1 Method of Using Organic Compounds GIVAUDAN SA (CH) 2009-12-17 US disclosed
EP-2046147-A1 METHOD OF USING ORGANIC COMPOUNDS Givaudan SA (CH) 2009-04-15 EP disclosed
US-7378551-B2 Amide compound KAO CORPORATION (JP) 2008-05-27 US disclosed
WO-2008011742-A1 METHOD OF USING ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2008-01-31 WO disclosed
US-20070185208-A1 Amide compound KAO CORPORATION (JP) 2007-08-09 US disclosed
US-5872111-A TOILET BAR SOAP, FACIAL BODY CLEANSER, SHAMPOO, CONDITIONER, COSMETIC,SHAVING CREAM OR LOTION, SHOWER GEL, FABRIC SOFTENING CONDITIONER, AND UNDERARM DEODORANT/ANTI-PERSPIRANT LEVER BROTHERS COMPANY, DIVISION OF CONOPCO, INC. (US) 1999-02-16 US disclosed
EP-0140321-B1 USE OF DERIVATIVES OF AMIDES OF CARBOXYLIC ACIDS IN WHICH THE N ATOM IS SUBSTITUTED BY A GLYCOSYL RADICAL AS GROWTH PROMOTOR IN ANIMAL NUTRITION BAYER AG (DE) 1989-04-12 EP disclosed
US-4710491-A N-glycosylated carboxylic acid derivatives as agents for combating rheumatic diseases TROPONWERKE GMBH & CO., KG (DE) 1987-12-01 US disclosed
US-4683222-A STIMULANTS FOR IMMUNE SYSTEM BAYER AKTIENGESELLSCHAFT (DE) 1987-07-28 US disclosed
US-4680287-A N-glycosylated carboxamide derivatives as growth-promoters in livestock feeding BAYER AKTIENGESELLSCHAFT (DE) 1987-07-14 US disclosed
EP-0091645-B1 DERIVATIVES OF AMIDES OF CARBOXYLIC ACIDS IN WHICH THE N ATOM IS SUBSTITUTED BY A GLYCOSYL RADICAL, METHOD FOR THEIR PREPARATION AND THEIR USE TO INFLUENCE THE IMMUNOGENIC SYSTEM BAYER AG (DE) 1987-02-25 EP disclosed
EP-0147777-A2 Derivatives of M-glycosylated amides of carboxylic acids as a product for combating diseases of the rheumatism type Troponwerke GmbH & Co. KG (DE) 1985-07-10 EP disclosed
EP-0140321-A2 Use of derivatives of amides of carboxylic acids in which the N atom is substituted by a glycosyl radical as growth promotor in animal nutrition BAYER AG (DE) 1985-05-08 EP disclosed
EP-0091645-A1 Derivatives of amides of carboxylic acids in which the N atom is substituted by a glycosyl radical, method for their preparation and their use to influence the immunogenic system BAYER AG (DE) 1983-10-19 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 (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-20070185208-A1 Amide compound H1-0, H1-2, H1-4 CA1 4192/4885ACE2 4560/4885FFAR1 88/4885
US-20090311403-A1 Method of Using Organic Compounds MGLL, GK, LIPC CA1 3332/4885ACE2 3055/4885FFAR1 321/4885

“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.