SCHEMBL215109

SCHEMBL215109

CCCC(CCC)CCC

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA7 P43166 1/20 0.39
CA14 Q9ULX7 1/20 0.39
TSHR P16473 5/20 0.39
TDP1 Q9NUW8 2/20 0.37
CHRM1 P11229 1/20 0.37
AKR1A1 P14550 1/20 0.37
CHRM3 P20309 1/20 0.37
HTR2A P28223 1/20 0.37
HTR2C P28335 1/20 0.37
ADRA1A P35348 1/20 0.37
HRH1 P35367 1/20 0.37
DRD3 P35462 1/20 0.37
SLC6A3 Q01959 1/20 0.37
HDAC1 Q13547 1/20 0.37
HDAC2 Q92769 1/20 0.37
CYP3A4 P08684 3/20 0.35
NFKB1 P19838 2/20 0.35

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
Hypochlorous Acid SCHEMBL11421756 0.88 TSHR (0.40) CA12CA1CA2CA7CA14
SCHEMBL25382283 0.88 ALDH1A1 (0.41) CA12CA1CA2CA7CA14
SCHEMBL11861735 0.88 LMNA (0.48) CA12CA1CA2CA7CA14
SCHEMBL824882 0.84 ALDH1A1 (0.52) CA2TSHRTDP1CYP3A4FDPS
SCHEMBL5424467 0.84 ALDH1A1 (0.52) CA2TSHRTDP1CYP3A4FDPS
SCHEMBL82932 0.82
SCHEMBL82509 0.82
SCHEMBL4269752 0.82 CA12 (0.36) CA12CA1CA2CA7CA14
SCHEMBL1996190 0.82 CA12 (0.32) CA12CA1CA2CA7CA14
SCHEMBL1101221 0.82 TSHR (0.43) CA12CA1CA2CA7CA14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240140888-A1 COMPOSITION COMPRISING AN ALKANE AND AN OXOESTER BIOSYNTHIS (FR) 2024-05-02 US claimed
CN-117941117-A Electrolyte, secondary battery, battery module, battery pack, and electricity device 宁德时代新能源科技股份有限公司 2024-04-26 CN claimed
EP-4321651-A1 COMPOSITION COMPRISING AN ALKANE AND AN OXO ESTER Biosynthis (FR) 2024-02-14 EP claimed
EP-4225471-A1 METHOD FOR CLEANING A GAS MIXTURE BY ADDING OZONE Hitachi Zosen Inova AG (CH) 2023-08-16 EP claimed
WO-2022079004-A1 METHOD FOR CLEANING A GAS MIXTURE BY ADDING OZONE HITACHI ZOSEN INOVA AG (CH) 2022-04-21 WO claimed
CN-105481801-B Preparation method of pregabalin chiral intermediate 广东莱佛士制药技术有限公司 2021-08-13 CN claimed
CN-107207384-B Process for preparing oligomers of olefins 公共型股份公司希布尔控股 2021-03-23 CN claimed
CN-112080037-A Flame retardant and preparation method thereof, flame-retardant material and preparation method thereof 安徽省百合新材料有限公司 2020-12-15 CN claimed
EP-3237363-B1 METHODS OF PREPARING OLIGOMERS OF AN OLEFIN SIBUR HOLDING PUBLIC JOINT STOCK CO (RU) 2019-05-01 EP claimed
US-10099970-B2 Methods of preparing oligomers of an olefin Public Joint Stock Company “SIBUR Holding” (RU) 2018-10-16 US claimed
US-7026426-B2 Room temperature curable organopolysiloxane compositions SHIN-ETSU CHEMICAL CO., LTD. (JP) 2006-04-11 US claimed
US-20040140030-A1 PNEUMATIC RUBBER TIRE HAVING ANNULAR RUBBER STRIP CONTAINING ELECTRICALLY CONDUCTIVE BONDED TO ITS INNER SURFACE GOODYEAR TIRE & RUBBER COMPANY, THE 2004-07-22 US claimed
EP-1439079-A2 Pneumatic tire having annular rubber strip containing electrically conductive element bonded to its inner surface THE GOODYEAR TIRE & RUBBER COMPANY (US) 2004-07-21 EP claimed
EP-0704494-B1 One package, room-temperature-vulcanizable silicone elastomer composition DOW CORNING TORAY SILICONE (JP) 2001-11-21 EP claimed
US-5639823-A DIORGANOPOLYSILOXANE ENDBLOCKED BY OXIME GROUP CONTAINING RADICALS; NONCRACKING, WORKABLE DOW CORNING TORAY SILICONE CO., LTD. (JP) 1997-06-17 US claimed
EP-0704494-A2 One package, room-temperature-vulcanizable, silicone elastomer composition Dow Corning Toray Silicone Co., Ltd. (JP) 1996-04-03 EP claimed
EP-0135293-B1 ROOM TEMPERATURE VULCANIZABLE POLYORGANOSILOXANE COMPOSITIONS CONTAINING KETOXIMOSILANES AND ORGANOTITANATES Toray Silicone Company Limited (JP) 1988-04-20 EP claimed
US-4555560-A Room temperature vulcanizable polyorganosiloxane compositions containing ketoximosilanes and organotitanates TORAY SILICONE COMPANY, LTD. (JP) 1985-11-26 US claimed
EP-0135293-A1 Room temperature vulcanizable polyorganosiloxane compositions containing ketoximosilanes and organotitanates Toray Silicone Company Limited (JP) 1985-03-27 EP claimed
US-4246240-A USING AN ALKYL PHOSPHONATE ORGANIC EXTRACTION MEDIUM NIPPON MINING CO., LTD. (JP) 1981-01-20 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-20240140888-A1 COMPOSITION COMPRISING AN ALKANE AND AN OXOESTER ALKBH2, ABHD12, FAAH2 CA12 127/4885CA1 1936/4885CA2 2841/4885

“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.