SCHEMBL429953

SCHEMBL429953

CCC(C)(C)C(=O)C(C)(C)CC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR3 O14843 2/20 0.41
HMGCR P04035 1/20 0.38
CHRM1 P11229 1/20 0.38
TBXA2R P21731 1/20 0.38
ADRA1A P35348 1/20 0.38
TDP1 Q9NUW8 4/20 0.38
TSHR P16473 3/20 0.38
CYP2D6 P10635 1/20 0.36
CYP2C19 P33261 1/20 0.36
HIF1A Q16665 1/20 0.36
RIPK1 Q13546 6/20 0.35
HDAC3 O15379 1/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC2 Q92769 1/20 0.35
HDAC8 Q9BY41 1/20 0.35
ALDH1A1 P00352 4/20 0.33
MEN1 O00255 1/20 0.33
CYP1A2 P05177 1/20 0.33
THRB P10828 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL13172935 0.87 FFAR3 (0.37) FFAR3HMGCRCHRM1TBXA2RADRA1A
SCHEMBL14538815 0.86 MEN1 (0.36) FFAR3TDP1RIPK1HDAC3HDAC1
SCHEMBL19388236 0.86 RIPK1 (0.38) FFAR3HMGCRCHRM1TBXA2RADRA1A
SCHEMBL18472023 0.84 FFAR3 (0.35) FFAR3HMGCRCHRM1TBXA2RADRA1A
SCHEMBL21316876 0.84 HMGCR (0.35) FFAR3HMGCRCHRM1TBXA2RADRA1A
SCHEMBL18291777 0.82 CES2 (0.41) FFAR3HMGCRCHRM1TBXA2RADRA1A
SCHEMBL16358242 0.82 MEN1 (0.38) FFAR3HMGCRCHRM1TBXA2RADRA1A
SCHEMBL23267029 0.82
SCHEMBL16298974 0.80 MEN1 (0.37) FFAR3HMGCRCHRM1TBXA2RADRA1A
SCHEMBL553596 0.79 TDP1 (0.38) FFAR3HMGCRCHRM1TBXA2RADRA1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3336815-B1 COMPOSITE MATERIAL FOR SIGNALLING LOCAL OVERHEATING OF ELECTRICAL EQUIPMENT LLC TERMOELEKTRICA (RU) 2024-10-09 EP claimed
EP-3336813-B1 DEVICE FOR WARNING OF PRE-FIRE SITUATIONS ARISING AS A RESULT OF LOCAL OVERHEATING OF ELECTRICAL EQUIPMENT LLC TERMOELEKTRICA (RU) 2024-10-09 EP claimed
CN-106315906-B The removal methods and device of coal ash and oily ammonia phenol in a kind of coal chemical industrial waste water 中国科学院过程工程研究所 2019-09-13 CN claimed
US-20180240317-A1 Composite material for signaling local overheating of electrical equipment LIMITED RESPONSIBILITY COMPANY "TERMOELEKTRIKA" (RU) 2018-08-23 US claimed
EP-3336813-A2 DEVICE FOR WARNING OF PRE-FIRE SITUATIONS ARISING AS A RESULT OF LOCAL OVERHEATING OF ELECTRICAL EQUIPMENT Limited Liability Company "Termoelektrica" (RU) 2018-06-20 EP claimed
EP-3336815-A1 COMPOSITE MATERIAL FOR SIGNALLING LOCAL OVERHEATING OF ELECTRICAL EQUIPMENT Limited Liability Company "Termoelektrica" (RU) 2018-06-20 EP claimed
US-20170349534-A1 A NOVEL PROCESS FOR CHIRAL RESOLUTION OF HIGHLY PURE (6R)-6-(DIMETHYLAMINO)-4,4-DIPHENYL-HEPTANONE FROM RACEMIC METHADONE HYDROCHLORIDE HARMAN FINOCHEM LIMITED (IN) 2017-12-07 US claimed
EP-3237373-A1 \"A NOVEL PROCESS FOR CHIRAL RESOLUTION OF HIGHLY PURE (6R)-6-(DIMETHYLAMINO)-4,4-DIPHENYL-3-HEPTANONE FROM RACEMIC METHADONE HYDROCHLORIDE\ Harman Finochem Limited (IN) 2017-11-01 EP claimed
CN-106315906-A Method and device for removing coal ash, and oil, phenols and ammonia from coal chemical industry wastewater 中国科学院过程工程研究所 2017-01-11 CN claimed
WO-2016103274-A1 \"A NOVEL PROCESS FOR CHIRAL RESOLUTION OF HIGHLY PURE (6R)-6-(DIMETHYLAMINO)-4,4-DIPHENYL-3-HEPTANONE FROM RACEMIC METHADONE HYDROCHLORIDE\ HARMAN FINOCHEM LIMITED (IN) 2016-06-30 WO claimed
EP-0551111-A1 Process for purifying acrylic acid to high purity in the production of acrylic acid NIPPON SHOKUBAI CO., LTD. (JP) 1993-07-14 EP claimed
EP-0141775-B1 CONTINUOUS PROCESS FOR THE PRODUCTION OF 1,2-ALKANE DIOLS CIBA-GEIGY AG (CH) 1987-10-28 EP claimed
US-4479021-A ESTERIFICATION, PEROXIDATION OF 1-ALKENE WITH FORMIC ACID, AND HYDROGEN PEROXIDE, THEN SAPONIFICATION CIBA-GEIGY CORPORATION (US) 1984-10-23 US claimed
US-4317752-A POLYURETHANE FOAMS; INSULATION; CONSTRUCTION MATERIALS BLOUNT DAVID H 1982-03-02 US claimed
US-4280006-A Process for the production of polyisocyanate silicate plastics utilizing an alkali metal cellulose silicate condensation product BLOUNT DAVID H 1981-07-21 US claimed
US-4262108-A FIREPROOF CONSTRUCTION MATERIALS, INSULATION BLOUNT DAVID H 1981-04-14 US claimed
US-4238375-A Process for the production of organic halosilicon acid resinous products and their reaction products utilizing phenol compounds BLOUNT DAVID H 1980-12-09 US claimed
US-4198491-A Process for the production of organic halosilicon acid resinous products and their reaction products BLOUNT DAVID H 1980-04-15 US claimed
US-4153764-A Process for the production of polyisocyanate organic silicate solid/cellular solid product BLOUNT DAVID H 1979-05-08 US claimed
US-3981831-A REACTION OF ORGANIC POLYISOCYANATE WITH ALKALI METAL SILICATE OR SILICA SOL BAYER AKTIENGESELLSCHAFT (DT) 1976-09-21 US claimed

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-20170349534-A1 A NOVEL PROCESS FOR CHIRAL RESOLUTION OF HIGHLY PURE (6R)-6-(DIMETHYLAMINO)-4,4-DIPHENYL-HEPTANONE FROM RACEMIC METHADONE HYDROCHLORIDE OPRK1, OPRM1, CYP2D6 FFAR3 926/4885HMGCR 281/4885CHRM1 456/4885

“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.