SCHEMBL4128716

SCHEMBL4128716

O=C(O)C(CCCCl)C(=O)O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ENPEP Q07075 1/20 0.37
TSHR P16473 2/20 0.35
LMNA P02545 1/20 0.35
ALDH1A1 P00352 3/20 0.33
TDP1 Q9NUW8 2/20 0.33
TBXAS1 P24557 1/20 0.33
DDAH1 O94760 2/20 0.32
GSR P00390 1/20 0.32
CA2 P00918 1/20 0.32
MAPK1 P28482 1/20 0.32
CHRM1 P11229 1/20 0.32
AKR1A1 P14550 1/20 0.32
CHRM3 P20309 1/20 0.32
HTR2A P28223 1/20 0.32
HTR2C P28335 1/20 0.32
ADRA1A P35348 1/20 0.32
HRH1 P35367 1/20 0.32
DRD3 P35462 1/20 0.32
SLC6A3 Q01959 1/20 0.32
HDAC1 Q13547 1/20 0.32

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
SCHEMBL5856024 0.92 TBXAS1 (0.36) ENPEPTSHRLMNAALDH1A1TDP1
SCHEMBL6474908 0.89 TBXAS1 (0.39) ENPEPTSHRLMNAALDH1A1TBXAS1
SCHEMBL5855808 0.89 TBXAS1 (0.39) ENPEPTSHRLMNAALDH1A1TBXAS1
SCHEMBL10576164 0.85 CA2 (0.32) TDP1CA2MAPK1CHRM1AKR1A1
SCHEMBL9705800 0.81 ENPEP (0.40) ENPEPTSHRLMNAALDH1A1TDP1
SCHEMBL9308206 0.81 ENPEP (0.43) ENPEPALDH1A1TDP1TBXAS1GSR
SCHEMBL12851496 0.81 GSR (0.43) ENPEPTDP1TBXAS1GSRCA2
SCHEMBL7753637 0.78
SCHEMBL28733920 0.78
SCHEMBL1706453 0.78

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1533322-B1 SOLID CATALYST COMPONENT FOR OLEFIN POLYMERIZATION AND CATALYST TOHO TITANIUM CO LTD (JP) 2019-05-01 EP disclosed
EP-2658855-A2 NOVEL POLYKETIDE COMPOUNDS AND METHODS OF MAKING SAME Acies Bio d.o.o. (SI) 2013-11-06 EP disclosed
WO-2012089349-A2 NOVEL POLYKETIDE COMPOUNDS AND METHODS OF MAKING SAME ACIES BIO D.O.O. (SI) 2012-07-05 WO disclosed
US-20090118314-A1 TUMOR SUPPRESSOR JAPAN AS REPRESENTED BY DIRECTOR GENERAL OF AGENCY CENTER (JP) 2009-05-07 US disclosed
EP-2022500-A1 TUMOR SUPPRESSOR JAPAN as represented by DIRECTOR GENERAL OF AGENCY OF NACIONAL CANCER CENTER (JP) 2009-02-11 EP disclosed
US-7208435-B2 Solid catalyst component for olefin polymerization and catalyst TOHO CATALYST CO., LTD. (JP) 2007-04-24 US disclosed
US-7144906-B2 Heterocyclic compounds NIPPON SHINYAKU CO., LTD. (JP) 2006-12-05 US disclosed
US-7030143-B2 Heterocyclic compounds NIPPON SHINYAKU CO., LTD. (JP) 2006-04-18 US disclosed
US-7022723-B2 Heterocyclic compounds NIPPON SHINYAKU CO., LTD. (JP) 2006-04-04 US disclosed
EP-1634876-A2 Heterocyclic compounds for the treatment of hyperlipidemia agents Nippon Shinyaku Co., Ltd. (JP) 2006-03-15 EP disclosed
EP-0929519-B1 BETA-SULFONYL HYDROXAMIC ACIDS AS MATRIX METALLOPROTEINASES INHIBITORS UPJOHN CO (US) 2005-02-23 EP disclosed
US-20050009892-A1 Heterocyclic compounds NIPPON SHINYAKU CO., LTD. (JP) 2005-01-13 US disclosed
US-20050009785-A1 Heterocyclic compounds KUWABARA KENJI (JP) 2005-01-13 US disclosed
US-20040162325-A1 Heterocyclic compounds KUWABARA KENJI (JP) 2004-08-19 US disclosed
US-20030166697-A1 Heterocyclic compounds NIPPON SHINYAKU CO., LTD. (JP) 2003-09-04 US disclosed
EP-1295875-A1 HETEROCYCLIC COMPOUNDS Nippon Shinyaku Co., Ltd. (JP) 2003-03-26 EP disclosed
US-6235928-B1 ENZYME INHIBITOR MATRIX METALLOPROTEINASE FAMILY, INCLUDING COLLAGENASE, STROMELYSIN, AND GELATINASE, THE COMPOUNDS OR PHARMACEUTICAL COMPOSITIONS PHARMACIA & UPJOHN COMPANY 2001-05-22 US disclosed
EP-0929519-A1 $g(b)-SULFONYL HYDROXAMIC ACIDS AS MATRIX METALLOPROTEINASES INHIBITORS PHARMACIA & UPJOHN COMPANY (US) 1999-07-21 EP disclosed
US-5847153-A β-sulfonyl hydroxamic acids PHARMACIA & UPJOHN COMPANY (US) 1998-12-08 US disclosed
WO-1998013340-A1 β-SULFONYL HYDROXAMIC ACIDS AS MATRIX METALLOPROTEINASES INHIBITORS PHARMACIA & UPJOHN COMPANY (US) 1998-04-02 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 (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-20050009785-A1 Heterocyclic compounds LIPC, GPR119, APOB ENPEP 1911/4885TSHR 1666/4885LMNA 606/4885
US-20050009892-A1 Heterocyclic compounds GPR119, LIPC, LIPE ENPEP 2177/4885TSHR 2487/4885LMNA 601/4885
US-20090118314-A1 TUMOR SUPPRESSOR VHL, APC, SRRT ENPEP 3635/4885TSHR 3055/4885LMNA 2856/4885
US-20040162325-A1 Heterocyclic compounds LIPE, GPR119, LIPC ENPEP 1844/4885TSHR 2672/4885LMNA 636/4885
US-20030166697-A1 Heterocyclic compounds LIPE, GPR119, LIPC ENPEP 1844/4885TSHR 2672/4885LMNA 636/4885

“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.