SCHEMBL277115

SCHEMBL277115

O=C1CCCCC=C1C1=CCCCCC1=O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSTP1 P09211 2/20 0.37
HDAC4 P56524 1/20 0.37
HDAC2 Q92769 1/20 0.37
HDAC8 Q9BY41 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
MAPT P10636 1/20 0.35
HIF1A Q16665 1/20 0.34
TRIM24 O15164 2/20 0.33
TRIM33 Q9UPN9 2/20 0.33
KDM1A O60341 1/20 0.33
TYMP P19971 1/20 0.33
ALDH1A1 P00352 3/20 0.32
CYP3A4 P08684 1/20 0.32
TP53 P04637 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
USP2 O75604 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
ALOX15 P16050 1/20 0.31
CYP2A6 P11509 1/20 0.30

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
SCHEMBL11502520 0.92 MAPT (0.41) GSTP1HDAC4HDAC2HDAC8HDAC6
SCHEMBL10802875 0.84 MAPT (0.37) GSTP1HDAC4HDAC2HDAC8HDAC6
SCHEMBL11883529 0.84 TYMP (0.40) GSTP1HDAC4HDAC2HDAC8HDAC6
SCHEMBL2490095 0.80 GSTP1 (0.32) GSTP1ALDH1A1CYP3A4
SCHEMBL9764177 0.78 HIF1A (0.31) HIF1A
SCHEMBL8893889 0.77 ALOX15 (0.34) GSTP1MEN1KMT2AALOX15
SCHEMBL1719496 0.76
SCHEMBL25365091 0.74
SCHEMBL11248818 0.74
SCHEMBL15133421 0.74

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1097925-B1 NOVEL BENZOIC ACID DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF NIPPON SODA CO (JP) 2006-09-13 EP claimed
US-6756497-B1 REACTING SUBSTITUTED BICYCLOHEPTENONE WITH ALKALI METAL ALKOXIDE OR ALKALI METAL OR ALKALINE EARTH METAL HYDROXIDE AND WATER OR METHANOL, ETHANOL, PROPANOL, ISOPROPANOL, BUTANOL OR TERT-BUTANOL IN LISTED ALCOHOLS OR TETRAHYDROFURAN AS SOLVENT NIPPON SODA CO., LTD. (JP) 2004-06-29 US claimed
EP-1097925-A1 NOVEL BENZOIC ACID DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF NIPPON SODA CO., LTD. (JP) 2001-05-09 EP claimed
EP-0074856-A2 Resolution of racemic bicycloheptenones GLAXO GROUP LIMITED (GB) 1983-03-23 EP claimed
US-8632759-B2 Hair restorer COSMO OIL CO., LTD. (JP) 2014-01-21 US disclosed
US-20120122974-A1 HAIR RESTORER COSMO OIL CO., LTD. (JP) 2012-05-17 US disclosed
US-8133479-B2 Hair restorer COSMO OIL CO., LTD. (JP) 2012-03-13 US disclosed
US-20090182033-A1 Cyclic Amine Derivatives and Their Uses ARGENTA DISCOVERY LTD. (GB) 2009-07-16 US disclosed
EP-1971572-A1 CYCLIC AMINE DERIVATIVES AND THEIR USES Argenta Discovery Limited (GB) 2008-09-24 EP disclosed
US-20070249721-A1 Hair Restorer COSMO ALA CO., LTD. (JP) 2007-10-25 US disclosed
WO-2007068929-A1 CYCLIC AMINE DERIVATIVES AND THEIR USES ARGENTA DISCOVERY LTD. (GB) 2007-06-21 WO disclosed
EP-1097925-B1 NOVEL BENZOIC ACID DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF NIPPON SODA CO (JP) 2006-09-13 EP disclosed
EP-0100900-A1 Novel (3.2.0.) bicycloheptanone oxime ethers with valuable therapeutic properties SYNTEX (U.S.A.) INC. (US) 1984-02-22 EP disclosed
EP-0074856-A3 RESOLUTION OF RACEMIC BICYCLOHEPTENONES GLAXO GROUP LIMITED (GB) 1984-02-01 EP disclosed
EP-0074856-A3 RESOLUTION OF RACEMIC BICYCLOHEPTENONES GLAXO GROUP LIMITED (GB) 1984-02-01 EP disclosed
US-4423068-A (3.2.0) Bicycloheptanone oxime ethers with therapeutic properties SYNTEX (U.S.A.) INC. (US) 1983-12-27 US disclosed
EP-0074856-A2 Resolution of racemic bicycloheptenones GLAXO GROUP LIMITED (GB) 1983-03-23 EP disclosed
EP-0074856-A2 Resolution of racemic bicycloheptenones GLAXO GROUP LIMITED (GB) 1983-03-23 EP disclosed
EP-0074856-A2 Resolution of racemic bicycloheptenones GLAXO GROUP LIMITED (GB) 1983-03-23 EP disclosed
US-3899678-A Radiation sensitive marking and process utilizing same BELL TELEPHONE LABOR INC 1975-08-12 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 (1 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-20090182033-A1 Cyclic Amine Derivatives and Their Uses CHRM2, CHRM3, CHRM1 GSTP1 3261/4885HDAC4 1901/4885HDAC2 1190/4885

“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.