SCHEMBL628303

SCHEMBL628303

O=C(O)C(c1ccccc1)C1(O)CCCC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.56
CHRM2 P08172 2/20 0.56
CHRM1 P11229 2/20 0.56
CHRM3 P20309 2/20 0.56
SMN1; SMN2 Q16637 1/20 0.55
CHRM4 P08173 1/20 0.52
CYP2D6 P10635 1/20 0.43
SRC P12931 1/20 0.43
MAPK1 P28482 1/20 0.42
AKR1C1 Q04828 1/20 0.41
GAA P10253 1/20 0.40
OPRM1 P35372 1/20 0.38
OPRD1 P41143 1/20 0.38
OPRK1 P41145 1/20 0.38
OPRL1 P41146 1/20 0.38
ATM Q13315 1/20 0.38
SLC6A2 P23975 1/20 0.37
SLC6A4 P31645 1/20 0.37
SLC6A3 Q01959 1/20 0.37

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
SCHEMBL29845505 1.00 LMNA (0.56) LMNACHRM2CHRM1CHRM3SMN1; SMN2
SCHEMBL14489601 0.98 LMNA (0.55) LMNACHRM2CHRM1CHRM3SMN1; SMN2
SCHEMBL13628924 0.98 LMNA (0.55) LMNACHRM2CHRM1CHRM3SMN1; SMN2
SCHEMBL13842135 0.96 LMNA (0.52) LMNACHRM2CHRM1CHRM3SMN1; SMN2
SCHEMBL3956434 0.88 CHRM2 (0.47) LMNACHRM2CHRM1CHRM3SMN1; SMN2
SCHEMBL1999106 0.87 LMNA (0.55) LMNACHRM2CHRM1CHRM3SMN1; SMN2
SCHEMBL10808122 0.85 LMNA (0.54) LMNACHRM2CHRM1CHRM3SMN1; SMN2
SCHEMBL10299132 0.85 LMNA (0.57) LMNACHRM2CHRM1CHRM3SMN1; SMN2
SCHEMBL3961366 0.84 CHRM2 (0.47) LMNACHRM2CHRM1CHRM3SMN1; SMN2
SCHEMBL3992289 0.84 CHRM2 (0.47) LMNACHRM2CHRM1CHRM3SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112129849-B Method for detecting phenylacetic acid and 2-cyclopentylidene-2-phenylacetic acid in (1-hydroxycyclopentyl) phenylacetic acid 山东绅联生物科技有限公司 2022-09-09 CN claimed
CN-112129849-A Method for detecting phenylacetic acid and 2-cyclopentylidene-2-phenylacetic acid in (1-hydroxycyclopentyl) phenylacetic acid 山东绅联生物科技有限公司 2020-12-25 CN claimed
EP-2822653-A2 NEW C-GLYCOSYLPOLYPHENOL ANTIDIABETIC AGENTS, EFFECT ON GLUCOSE TOLERANCE AND INTERACTION WITH BETA-AMYLOID. THERAPEUTIC APPLICATIONS OF THE SYNTHESIZED AGENT(S) AND OF GENISTA TENERA ETHYL ACETATE EXTRACTS CONTAINING SOME OF THOSE AGENTS Universidade de Lisboa (PT) 2015-01-14 EP claimed
WO-2013132470-A2 NEW C-GLYCOSYLPOLYPHENOL ANTIDIABETIC AGENTS, EFFECT ON GLUCOSE TOLERANCE AND INTERACTION WITH BETA-AMYLOID. THERAPEUTIC APPLICATIONS OF THE SYNTHESIZED AGENT(S) AND OF GENISTA TENERA ETHYL ACETATE EXTRACTS CONTAINING SOME OF THOSE AGENTS UNIVERSIDADE DE LISBOA (PT) 2013-09-12 WO claimed
US-20240094559-A1 CONTACT LENS AND PRODUCT THEREOF LARGAN MEDICAL CO., LTD. (TW) 2024-03-21 US disclosed
US-11867985-B2 Contact lens and product thereof LARGAN MEDICAL CO., LTD. (TW) 2024-01-09 US disclosed
US-20230393417-A1 MULTIFOCAL CONTACT LENS AND CONTACT LENS PRODUCT LARGAN MEDICAL CO., LTD. (TW) 2023-12-07 US disclosed
US-11782294-B2 Multifocal contact lens and contact lens product LARGAN MEDICAL CO., LTD. (TW) 2023-10-10 US disclosed
US-20230004022-A1 CONTACT LENS PRODUCT LARGAN MEDICAL CO., LTD. (TW) 2023-01-05 US disclosed
CN-112129849-B Method for detecting phenylacetic acid and 2-cyclopentylidene-2-phenylacetic acid in (1-hydroxycyclopentyl) phenylacetic acid 山东绅联生物科技有限公司 2022-09-09 CN disclosed
CN-112129849-B Method for detecting phenylacetic acid and 2-cyclopentylidene-2-phenylacetic acid in (1-hydroxycyclopentyl) phenylacetic acid 山东绅联生物科技有限公司 2022-09-09 CN disclosed
CN-112129849-B Method for detecting phenylacetic acid and 2-cyclopentylidene-2-phenylacetic acid in (1-hydroxycyclopentyl) phenylacetic acid 山东绅联生物科技有限公司 2022-09-09 CN disclosed
WO-2010120935-A1 ANTI-VIRAL COMPOUNDS ABBOTT LABORATORIES (US) 2010-10-21 WO disclosed
US-20100267634-A1 Anti-Viral Compounds Abbott Labaoratories (US) 2010-10-21 US disclosed
EP-1546099-B1 3,6-DISUBSTITUTED AZABICYCLO 3.1.0 HEXANE DERIVATIVES USEFUL AS MUSCARINIC RECEPTOR ANTAGONISTS RANBAXY LAB LTD (IN) 2008-12-31 EP disclosed
US-7399779-B2 3,6-disubstituted azabicyclo [3.1.0] hexane derivatives useful as muscarinic receptor antagonists RANBAXY LABORATORIES LIMITED (IN) 2008-07-15 US disclosed
US-20070004791-A1 3,6-disubstituted azabicyclo {3.1.0} hexane derivatives useful as muscarnic receptor antagonists RANBAXY LABORATORIES LIMITED (IN) 2007-01-04 US disclosed
EP-1546099-A4 3,6-DISUBSTITUTED AZABICYCLO 3.1.0 HEXANE DERIVATIVES USEFUL AS MUSCARINIC RECEPTOR ANTAGONISTS RANBAXY LAB LTD (IN) 2006-08-02 EP disclosed
EP-1546099-A2 3,6-DISUBSTITUTED AZABICYCLO 3.1.0 HEXANE DERIVATIVES USEFUL AS MUSCARINIC RECEPTOR ANTAGONISTS Ranbaxy Laboratories Limited (IN) 2005-06-29 EP disclosed
WO-2004004629-A2 3,6-DISUBSTITUTED AZABICYCLO [3.1.0]HEXANE DERIVATIVES USEFUL AS MUSCARINIC RECEPTOR ANTAGONISTS RANBAXY LABORATORIES LIMITED (IN) 2004-01-15 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-20100267634-A1 Anti-Viral Compounds HAVCR2, EIF2AK2, MAVS LMNA 3118/4885CHRM2 4875/4885CHRM1 4854/4885
US-20070004791-A1 3,6-disubstituted azabicyclo {3.1.0} hexane derivatives useful as muscarnic receptor antagonists CHRM3, CHRM5, CHRM2 LMNA 3111/4885CHRM2 3/4885CHRM1 4/4885

“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.