SCHEMBL2201247

SCHEMBL2201247

CCCC(=O)OC1CCOCC1

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 2/20 0.51
PDE4D Q08499 7/20 0.43
PDE4A P27815 6/20 0.43
PDE4B Q07343 6/20 0.43
PDE4C Q08493 6/20 0.43
ALDH1A1 P00352 1/20 0.41
KAT2B Q92831 1/20 0.36
BAZ2B Q9UIF8 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
EPHX1 P07099 1/20 0.34
HTT P42858 1/20 0.34
LMNA P02545 1/20 0.34
POLB P06746 1/20 0.34
TSHR P16473 1/20 0.34

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
SCHEMBL29830733 0.89 PDE4D (0.45) NAAAPDE4DPDE4APDE4BPDE4C
SCHEMBL29387041 0.86 NAAA (0.73) NAAALMNA
SCHEMBL19681634 0.86 NAAA (0.73) NAAALMNA
SCHEMBL8690677 0.86
SCHEMBL8394206 0.84 NAAA (0.42) NAAAPDE4DPDE4APDE4BPDE4C
Hydrochloric Acid SCHEMBL32662212 0.82 NAAA (0.41) NAAAPDE4DPDE4APDE4BPDE4C
SCHEMBL2433610 0.82 NAAA (0.67) NAAAALDH1A1SMN1; SMN2EPHX1HTT
SCHEMBL1695592 0.82 NAAA (0.72) NAAAALDH1A1SMN1; SMN2EPHX1HTT
SCHEMBL7815359 0.81 NAAA (0.51) NAAAALDH1A1SMN1; SMN2EPHX1HTT
SCHEMBL9134369 0.80 NAAA (0.73) NAAAALDH1A1SMN1; SMN2EPHX1HTT

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 16 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4308558-A1 MODULATORS OF FPR1 AND METHODS OF USING THE SAME BIOFRONT LTD (KY) 2024-01-24 EP disclosed
CN-109195959-B Tetrahydropyranyl lower alkyl esters and preparation using ketene compounds 巴斯夫欧洲公司 2023-08-18 CN disclosed
EP-3464258-A1 TETRAHYDROPYRANYL LOWER ALKYL ESTERS AND THE PRODUCTION OF SAME USING A KETENE COMPOUND BASF SE (DE) 2019-04-10 EP disclosed
WO-2017207539-A1 TETRAHYDROPYRANYL LOWER ALKYL ESTERS AND THE PRODUCTION OF SAME USING A KETENE COMPOUND BASF SE (DE) 2017-12-07 WO disclosed
US-20120283438-A1 COMPOUNDS GLAXOSMITHKLINE LLC (US) 2012-11-08 US disclosed
US-20110269781-A1 COMPOUNDS GLAXOSMITHKLINE LLC (US) 2011-11-03 US disclosed
US-20110230428-A1 CERTAIN KYNURENINE-3-MONOOXYGENASE INHIBITORS, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF USE THEREOF CHDI FOUNDATION, INC. 2011-09-22 US disclosed
US-7977344-B2 Compounds GLAXOSMITHKLINE LLC (US) 2011-07-12 US disclosed
EP-2125792-B1 PURINE DERIVATIVES AS IMMUNOMODULATORS GLAXOSMITHKLINE LLC (US) 2010-12-01 EP disclosed
US-20100120799-A1 PURINE DERIVATIVES AS IMMUNOMODULATORS SMITHKLINE BEECHAM CORPORATION (US) 2010-05-13 US disclosed
US-20090131458-A1 Compounds SMITHKLINE BEECHAM CORPORATION (US) 2009-05-21 US disclosed
US-4849436-A TREATMENT OF CARDIOVASCULAR DISORDERS NELSON RESEARCH & DEVELOPMENT CO. (US) 1989-07-18 US disclosed
EP-0259462-A1 1,4-DIHYDROPYRIDINES Whitby Research Incorporated (US) 1988-03-16 EP disclosed
WO-1987005512-A1 1,4-DIHYDROPYRIDINES NELSON RESEARCH AND DEVELOPMENT COMPANY (US) 1987-09-24 WO disclosed
EP-0099692-B1 NEW FURANONE DERIVATIVES, PROCESS FOR THE PREPARATION THEREOF AND USE THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1987-03-18 EP disclosed
US-4585789-A ALDOSE REDUCTASE INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-04-29 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 (5 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-20120283438-A1 COMPOUNDS LTC4S, LTB4R2, LTB4R NAAA 1190/4885PDE4D 928/4885PDE4A 495/4885
US-20090131458-A1 Compounds LTC4S, LTB4R2, LTB4R NAAA 1190/4885PDE4D 928/4885PDE4A 495/4885
US-20100120799-A1 PURINE DERIVATIVES AS IMMUNOMODULATORS LTC4S, STING1, LTB4R2 NAAA 2007/4885PDE4D 1206/4885PDE4A 488/4885
US-20110230428-A1 CERTAIN KYNURENINE-3-MONOOXYGENASE INHIBITORS, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF USE THEREOF KMO, KYNU, MAOA NAAA 441/4885PDE4D 1886/4885PDE4A 1314/4885
US-20110269781-A1 COMPOUNDS LTC4S, LTB4R2, LTB4R NAAA 1190/4885PDE4D 928/4885PDE4A 495/4885

“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.