SCHEMBL333417

SCHEMBL333417

CCCCC(CC)C(=O)OCC(C)C

nearest known ligand 0.63

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CA2 P00918 8/20 0.63
CA1 P00915 4/20 0.63
MAPK1 P28482 1/20 0.53
L3MBTL1 Q9Y468 2/20 0.44
TSHR P16473 4/20 0.43
ATM Q13315 2/20 0.43
CYP3A4 P08684 2/20 0.43
TDP1 Q9NUW8 1/20 0.43
GAA P10253 1/20 0.41
XBP1 P17861 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
RECQL P46063 1/20 0.40
ALDH1A1 P00352 1/20 0.38

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
SCHEMBL27713871 0.98 CA2 (0.61) CA2CA1MAPK1L3MBTL1TSHR
SCHEMBL27520082 0.98 CA2 (0.61) CA2CA1MAPK1L3MBTL1TSHR
SCHEMBL28829179 0.93 CA2 (0.55) CA2CA1MAPK1
SCHEMBL27478993 0.93 CA2 (0.55) CA2CA1MAPK1
SCHEMBL7223532 0.93 CA2 (0.55) CA2CA1MAPK1
SCHEMBL7217708 0.88 CA2 (0.47) CA2CA1MAPK1TSHRCYP3A4
SCHEMBL149487 0.87 CA2 (0.58) CA2CA1MAPK1L3MBTL1TSHR
SCHEMBL2316277 0.87 CA2 (0.61) CA2CA1MAPK1L3MBTL1TSHR
Ammonia Solution, Strong SCHEMBL27866368 0.85 CA2 (0.59) CA2CA1MAPK1L3MBTL1TSHR
SCHEMBL6893798 0.85 CA2 (0.48) CA2CA1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220185759-A1 PROCESSES FOR PRODUCING CARBOXYLIC ACIDS EASTMAN CHEMICAL COMPANY (US) 2022-06-16 US claimed
EP-3947337-A1 PROCESSES FOR PRODUCING CARBOXYLIC ACIDS EASTMAN CHEMICAL COMPANY (US) 2022-02-09 EP claimed
CN-113597423-A Process for producing carboxylic acid 伊士曼化工公司 2021-11-02 CN claimed
WO-2020205348-A1 PROCESSES FOR PRODUCING CARBOXYLIC ACIDS EASTMAN CHEMICAL COMPANY (US) 2020-10-08 WO claimed
CN-107108630-B Substituted N- (pyrrolidin-3-yl) -7H-pyrrolo [2,3-D ] pyrimidin-4-amines as JANUS kinase inhibitors 阳智化学(株) 2019-10-15 CN claimed
CN-107108630-A Substituted N- (pyrrolidin-3-yl) -7H-pyrrolo [2,3-D ] pyrimidin-4-amines as JANUS kinase inhibitors 阳智化学(株) 2017-08-29 CN claimed
CN-1190477-C Lubrication oil for refrigerator, hydraulic fluid compoistion for refrigerator and method for lubrication of refrigerator NEW JAPAN CHEMICALS CO LTD (JP) 2005-02-23 CN claimed
US-6667285-B1 Branched-chain carboxylic acid monoalkyl ester with outstanding hydrolytic stability NEW JAPAN CHEMICAL CO., LTD. (JP) 2003-12-23 US claimed
EP-1225213-A1 LUBRICATING OIL FOR REFRIGERATOR, HYDRAULIC FLUID COMPOSITION FOR REFRIGERATOR AND METHOD FOR LUBRICATION OF REFRIGERATOR NEW JAPAN CHEMICAL CO.,LTD. (JP) 2002-07-24 EP claimed
CN-1349555-A Lubrication oil for refrigerator, hydraulic fluid compoistion for refrigerator and method for lubrication of refrigerator NEW JAPAN CHEMICALS CO LTD (JP) 2002-05-15 CN claimed
JP-63000493-A None JP disclosed
CN-115501171-B High-concentration azelaic acid cream and preparation process thereof 上海丽舒丹医药科技有限公司 2025-01-14 CN disclosed
US-12152005-B2 Processes for producing carboxylic acids EASTMAN CHEMICAL COMPANY (US) 2024-11-26 US disclosed
CN-115501171-A High-concentration azelaic acid emulsifiable paste and preparation process thereof 上海丽舒丹医药科技有限公司 2022-12-23 CN disclosed
US-20220185759-A1 PROCESSES FOR PRODUCING CARBOXYLIC ACIDS EASTMAN CHEMICAL COMPANY (US) 2022-06-16 US disclosed
EP-0334956-A1 HEMOLYSIS INHIBITOR AND MEDICAL RESIN COMPOSITION, MEDICAL IMPLEMENT, AND BLOOD-PRESERVING FLUID CONTAINING THE SAME Kao Corporation (JP) 1989-10-04 EP disclosed
EP-0328158-A1 A method for improving the release of a cast concrete item from the mould by applying to the mould a mould release composition CASTROL A/S (DK) 1989-08-16 EP disclosed
JP-S63493-A CORROSION INHIBITOR FOR HYDRAULIC TEST JOHNSON KK 1988-01-05 JP disclosed
EP-0180630-A1 A METHOD FOR IMPROVING THE RELEASE OF A MOULDED CONCRETE BODY FROM THE MOULD. KOEGE KEMISK VAERK (DK) 1986-05-14 EP disclosed
WO-1985005066-A1 A METHOD FOR IMPROVING THE RELEASE OF A MOULDED CONCRETE BODY FROM THE MOULD KEMISK VA^ERK KO^/GE A/S (DK) 1985-11-21 WO 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-20220185759-A1 PROCESSES FOR PRODUCING CARBOXYLIC ACIDS HAO2, HPD, DDO CA2 375/4885CA1 39/4885MAPK1 2112/4885
US-12152005-B2 Processes for producing carboxylic acids HAO2, HPD, DDO CA2 375/4885CA1 39/4885MAPK1 2112/4885

“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.