SCHEMBL118994

SCHEMBL118994

CCCCCCCCC(=O)Oc1ccc(C(N)=O)cc1OC

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TOP2A P11388 2/20 0.60
MAPK1 P28482 1/20 0.58
MGLL Q99685 1/20 0.53
ALOX15 P16050 1/20 0.52
SMPD1 P17405 4/20 0.50
EPHX2 P34913 1/20 0.50
THRA P10827 1/20 0.49
THRB P10828 1/20 0.49
HDAC3 O15379 1/20 0.49
HDAC2 Q92769 1/20 0.49
POLB P06746 1/20 0.47

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
SCHEMBL8373083 1.00 TOP2A (0.60) TOP2AMAPK1MGLLALOX15SMPD1
SCHEMBL8372910 1.00 TOP2A (0.60) TOP2AMAPK1MGLLALOX15SMPD1
SCHEMBL8371960 1.00 TOP2A (0.60) TOP2AMAPK1MGLLALOX15SMPD1
SCHEMBL5088072 1.00 TOP2A (0.60) TOP2AMAPK1MGLLALOX15SMPD1
SCHEMBL14672687 0.88 TOP2A (0.61) TOP2AMGLLALOX15SMPD1THRA
SCHEMBL109694 0.88 TOP2A (0.61) TOP2AMGLLALOX15SMPD1THRA
SCHEMBL29581901 0.86 ALOX15 (0.52) TOP2AALOX15EPHX2
SCHEMBL15668298 0.86 ALOX15 (0.52) TOP2AALOX15EPHX2
SCHEMBL23630666 0.82 MAPK1 (0.71) MAPK1SMPD1THRATHRB
SCHEMBL598033 0.82 MAPK1 (0.71) MAPK1SMPD1THRATHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117801422-A Polypropylene composite material capable of preventing rats from biting and preparation method thereof 广东圆融新材料有限公司 2024-04-02 CN claimed
CN-116940382-A Topical composition 小林制药株式会社 2023-10-24 CN claimed
CN-114085563-A Green environment-friendly capsule release type antifouling paint and preparation method thereof 广东美涂士建材股份有限公司 2022-02-25 CN claimed
CN-113244520-A Smell transfer module 杨孟君 2021-08-13 CN claimed
EP-3691645-A1 PHARMACEUTICAL COMPOSITIONS COMPRISING DELAYED RELEASE GELLING AGENT COMPOSITIONS Purdue Pharma L.P. (US) 2020-08-12 EP claimed
WO-2019070581-A1 PHARMACEUTICAL COMPOSITIONS COMPRISING DELAYED RELEASE GELLING AGENT COMPOSITIONS PURDUE PHARMA L.P (US) 2019-04-11 WO claimed
US-20190046522-A1 PHARMACEUTICAL FORMULATION CONTAINING IRRITANT PURDUE PHARMA LP (US) 2019-02-14 US claimed
US-10028947-B2 Pharmaceutical formulation containing opioid agonist, opioid antagonist and irritant agent PURDUE PHARMA L.P. (US) 2018-07-24 US claimed
US-10022369-B2 Pharmaceutical formulation containing irritant PURDUE PHARMA L.P. (US) 2018-07-17 US claimed
EP-2900272-B1 ABUSE DETERRENT PHARMACEUTICAL COMPOSITION COMPRISING KONJAC GLUCOMANNAN PHARMASCIENCE INC (CA) 2018-06-06 EP claimed
EP-1414413-A1 COMPOSITIONS AND METHODS TO PREVENT ABUSE OF OPIOIDS Euro-Celtique S.A. (LU) 2004-05-06 EP claimed
US-20030068392-A1 Pharmaceutical formulation containing opioid agonist, opioid antagonist and irritant PURDUE PHARMA L.P. 2003-04-10 US claimed
US-20030068370-A1 Pharmaceutical formulation containing irritant PURDUE PHARMA L.P. 2003-04-10 US claimed
WO-2003013476-A1 COMPOSITIONS AND METHODS TO PREVENT ABUSE OF OPIOIDS EURO-CELTIQUE S.A. (LU) 2003-02-20 WO claimed
WO-2003013479-A1 COMPOSITIONS AND METHODS TO PREVENT ABUSE OF OPIOIDS EURO-CELTIQUE S.A. (LU) 2003-02-20 WO claimed
EP-0546078-B1 BIRDFOOD CONTAINING CAPSAICIN OR ITS DERIVATIVES OR ANALOGUES US HEALTH (US) 1999-02-24 EP claimed
EP-0546078-A4 BIRDFOOD CONTAINING CAPSAICIN OR ITS DERIVATIVES OR ANALOGUES US HEALTH (US) 1993-09-15 EP claimed
EP-0546078-A1 BIRDFOOD CONTAINING CAPSAICIN OR ITS DERIVATIVES OR ANALOGUES THE UNITED STATES OF AMERICA as represented by the Secretary UNITED STATES DEPARTMENT OF COMMERCE (US) 1993-06-16 EP claimed
WO-1992003923-A1 BIRDFOOD CONTAINING CAPSAICIN OR ITS DERIVATIVES OR ANALOGUES THE UNITED STATES OF AMERICA, represented by THE SCRETARY, UNITED STATES DEPARTMENT OF COMMERCE (US) 1992-03-19 WO claimed
US-5094782-A Synthesis of capsacin derivatives and their use as an analgesic drug and vessel dilation drug NATIONAL SCIENCE COUNCIL OF REPUBLIC OF CHINA (TW) 1992-03-10 US claimed