SCHEMBL1070989

SCHEMBL1070989

CC(=O)OC/C=C(\C)CC/C=C(\C)C=O

nearest known ligand 0.71

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.71
ALOX15 P16050 1/20 0.71
PTPN1 P18031 1/20 0.46
TRPV1 Q8NER1 3/20 0.43
FNTA P49354 2/20 0.43
FNTB P49356 2/20 0.43
PGGT1B P53609 1/20 0.43

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
SCHEMBL11785322 1.00 ALDH1A1 (0.71) ALDH1A1ALOX15PTPN1TRPV1FNTA
SCHEMBL1070992 1.00 ALDH1A1 (0.71) ALDH1A1ALOX15PTPN1TRPV1FNTA
SCHEMBL13288245 0.98 ALDH1A1 (0.69) ALDH1A1ALOX15PTPN1TRPV1FNTA
SCHEMBL29586651 0.88 ALDH1A1 (0.54) ALDH1A1ALOX15TRPV1FNTAFNTB
SCHEMBL28410357 0.86 ALDH1A1 (0.71) ALDH1A1ALOX15PTPN1TRPV1FNTA
SCHEMBL30342059 0.85 ALDH1A1 (0.51) ALDH1A1ALOX15TRPV1FNTAFNTB
SCHEMBL10613495 0.84 ALDH1A1 (0.73) ALDH1A1ALOX15PTPN1TRPV1FNTA
SCHEMBL10613500 0.84 ALDH1A1 (0.73) ALDH1A1ALOX15PTPN1TRPV1FNTA
SCHEMBL2560936 0.83 ALDH1A1 (0.72) ALDH1A1ALOX15PTPN1TRPV1FNTA
SCHEMBL2560933 0.83 ALDH1A1 (0.72) ALDH1A1ALOX15PTPN1TRPV1FNTA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210207183-A1 METHOD FOR PRODUCING MONOTERPENOID COMPOUNDS JOHN INNES CENTRE (GB) 2021-07-08 US disclosed
EP-3802837-A1 METHOD FOR PRODUCING MONOTERPENOID COMPOUNDS JOHN INNES CENTRE (GB) 2021-04-14 EP disclosed
CN-112513280-A Method for producing monoterpenes 约翰·英尼斯中心 2021-03-16 CN disclosed
EP-1879902-B1 COMPOSITION COMPRISING ONE OR MORE LYCOPHYLL DERIVATIVES CARDAX PHARMA INC (US) 2020-01-08 EP disclosed
US-9737504-B2 Dihydroorotic and acid dehydrogenase inhibitor INSTITUTE OF MITOCHONDRIA SCIENCE, INC. (JP) 2017-08-22 US disclosed
US-9657313-B2 Isoprene oligomer, polyisoprene, processes for producing these materials, rubber composition, and pneumatic tire SUMITOMO RUBBER INDUSTRIES, LTD. (JP) 2017-05-23 US disclosed
US-20160296494-A1 DIHYDROOROTIC AND ACID DEHYDROGENASE INHIBITOR NAI INC. 2016-10-13 US disclosed
US-9440913-B2 Dihydroxybenzene derivatives and antiprotozoal agent comprising same as active ingredient NAI INC. (JP) 2016-09-13 US disclosed
US-20160222418-A1 ISOPRENE OLIGOMER, POLYISOPRENE, PROCESSES FOR PRODUCING THESE MATERIALS, RUBBER COMPOSITION, AND PNEUMATIC TIRE SUMITOMO RUBBER INDUSTRIES, LTD. (JP) 2016-08-04 US disclosed
US-9371342-B2 Isoprene oligomer, polyisoprene, processes for producing these materials, rubber composition, and pneumatic tire SUMITOMO RUBBER INDUSTRIES, LTD. (JP) 2016-06-21 US disclosed
US-5053552-A Process for producing α,β-unsaturated aldehyde KURARAY COMPANY, LTD. (JP) 1991-10-01 US disclosed
EP-0412551-A2 Process for producing alpha, beta-unsaturated aldehyde KURARAY CO., LTD. (JP) 1991-02-13 EP disclosed
US-4947001-A Halogenating hydroxysulfone salt KURARAY COMPANY, LTD. (JP) 1990-08-07 US disclosed
EP-0187259-B1 PROCESS FOR PRODUCING VITAMIN A OR ITS CARBOXYLIC ACID ESTERS, AND INTERMEDIATE COMPOUNDS USEFUL FOR THE PROCESS KURARAY CO., LTD. (JP) 1990-06-13 EP disclosed
EP-0348813-A2 Process for producing halogenated sulfone KURARAY CO., LTD. (JP) 1990-01-03 EP disclosed
US-4876400-A DESULFONATION KURARAY CO., LTD. (JP) 1989-10-24 US disclosed
US-4825006-A A-ARYLSULFONYL- KURARAY CO., LTD. (JP) 1989-04-25 US disclosed
US-4745229-A OXIDATION, DECHLORINATION KURARAY COMPANY LTD. (JP) 1988-05-17 US disclosed
EP-0234496-A2 Process for preparing alpha, beta-unsaturated aldehydes Kuraray Co., Ltd. (JP) 1987-09-02 EP disclosed
EP-0187259-A2 Process for producing vitamin A or its carboxylic acid esters, and intermediate compounds useful for the process KURARAY CO., LTD. (JP) 1986-07-16 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-20160296494-A1 DIHYDROOROTIC AND ACID DEHYDROGENASE INHIBITOR DHODH, DPYD, DLD ALDH1A1 75/4885ALOX15 977/4885PTPN1 816/4885
US-20160222418-A1 ISOPRENE OLIGOMER, POLYISOPRENE, PROCESSES FOR PRODUCING THESE MATERIALS, RUBBER COMPOSITION, AND PNEUMATIC TIRE RCE1, GGPS1, TELO2 ALDH1A1 3351/4885ALOX15 312/4885PTPN1 4041/4885

“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.