SCHEMBL5372285

SCHEMBL5372285

C=Cc1ccc(O)c(CCC)c1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.49
ALOX5 P09917 1/20 0.46
HMGCR P04035 1/20 0.42
CNR1 P21554 1/20 0.40
CNR2 P34972 1/20 0.40
ESR1 P03372 4/20 0.39
ESR2 Q92731 4/20 0.39
GABRA1 P14867 1/20 0.39
GABRB2 P47870 1/20 0.39
PRKCI P41743 2/20 0.39
PTGS1 P23219 2/20 0.37
PTGS2 P35354 2/20 0.37
IAPP P10997 1/20 0.37
BACE1 P56817 1/20 0.36
ACHE P22303 1/20 0.36
ALDH1A1 P00352 1/20 0.36
AKR1B10 O60218 1/20 0.36
AKR1B1 P15121 1/20 0.36
AKR1C3 P42330 1/20 0.36

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
SCHEMBL5375049 0.89 TYR (0.47) TRPA1ALOX5ESR1ESR2GABRA1
SCHEMBL9312175 0.89 LCK (0.45) TRPA1ALOX5HMGCRESR1ESR2
SCHEMBL685057 0.88 TYR (0.47) TRPA1ALOX5IAPP
SCHEMBL11760568 0.86 TYR (0.50) TRPA1ALOX5
SCHEMBL685783 0.86 TYR (0.50) TRPA1ALOX5
SCHEMBL685611 0.85 TRPA1 (0.52) TRPA1ESR1ESR2GABRA1GABRB2
SCHEMBL1822487 0.85 LCK (0.50) ALOX5HMGCRCNR1CNR2PTGS1
SCHEMBL1822489 0.85 LCK (0.50) ALOX5HMGCRCNR1CNR2PTGS1
SCHEMBL12802190 0.82 ALDH1A1 (0.40) TRPA1ALOX5PRKCIPTGS1PTGS2
SCHEMBL3429484 0.81 KDM4E (0.53) ALOX5HMGCRCNR1CNR2ESR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7202359-B2 Azaoxa heterocyclic compound and method of preparing the same CHANG CHUN PLASTICS CO., LTD. (TW) 2007-04-10 US disclosed
CN-1234706-C Nitrogen-oxygen heterocyclic compound and preparation method thereof CHANGCHUN ARTIFICIAL RESIN FAC (CN) 2006-01-04 CN disclosed
US-20050085634-A1 Azaoxa heterocyclic compound and method of preparing the same CHANG CHUN PLASTICS CO., LTD. (TW) 2005-04-21 US disclosed
CN-1490318-A Nitrogen-oxygen heterocyclic compound and preparation method thereof 长春人造树脂厂股份有限公司 2004-04-21 CN disclosed
US-20040068084-A1 Azaoxa heterocyclic compound and method of preparing the same CHANG CHUN PLASTICS CO., LTD. (TW) 2004-04-08 US disclosed
US-6211328-B1 IN PRESENCE OF AN ACID GUN EI CHEMICAL INDUSTRY CO., LTD (JP) 2001-04-03 US disclosed
US-5376498-A Blend of an alkali-soluble resin, compound that generates an acid upon irradiation, functional aromatic compound and a phenolic compound JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1994-12-27 US disclosed
US-5326826-A Binder HOECHST AKTIENGESELLSCHAFT (DE) 1994-07-05 US disclosed
EP-0542572-A1 Negative type radiation-sensitive resin composition JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1993-05-19 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-20040068084-A1 Azaoxa heterocyclic compound and method of preparing the same AOX1, KDM1A, BMI1 TRPA1 2463/4885ALOX5 137/4885HMGCR 4417/4885
US-20050085634-A1 Azaoxa heterocyclic compound and method of preparing the same AOX1, KDM1A, BMI1 TRPA1 2367/4885ALOX5 112/4885HMGCR 4433/4885

“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.