SCHEMBL1180038

SCHEMBL1180038

COC(=O)c1ccc(OC)cc1Cl

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYK2 P29597 2/20 0.57
JAK2 O60674 1/20 0.57
KDM4E B2RXH2 3/20 0.56
CYP1A2 P05177 1/20 0.56
CYP2D6 P10635 1/20 0.56
CYP2C9 P11712 1/20 0.56
CYP2C19 P33261 1/20 0.56
FLT1 P17948 2/20 0.55
FLT4 P35916 2/20 0.55
KDR P35968 2/20 0.55
RAB9A P51151 2/20 0.53
MAPT P10636 1/20 0.53
NR4A2 P43354 1/20 0.51
CA1 P00915 3/20 0.50
CA2 P00918 3/20 0.50
ABL1 P00519 1/20 0.50
NPC1 O15118 1/20 0.50
ALDH1A1 P00352 2/20 0.49
HPGD P15428 2/20 0.49
TUBB4A P04350 1/20 0.49

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
SCHEMBL1180024 0.85 KDM4E (0.60) TYK2KDM4ECYP1A2CYP2D6CYP2C9
SCHEMBL7091405 0.85 RAB9A (0.65) TYK2JAK2CYP1A2CYP2D6CYP2C19
SCHEMBL516293 0.84 ABL1 (0.46) TYK2JAK2KDM4ECYP1A2CYP2D6
SCHEMBL1014886 0.84 ALDH1A1 (0.53) TYK2JAK2KDM4ECYP1A2CYP2D6
SCHEMBL3142619 0.83 TYK2 (0.55) TYK2JAK2CYP1A2CYP2D6CYP2C19
SCHEMBL295414 0.83 SMN1; SMN2 (0.57) TYK2JAK2KDM4EFLT1FLT4
SCHEMBL473972 0.83 ALDH1A1 (0.65) TYK2JAK2KDM4ECYP1A2CYP2C19
SCHEMBL21434767 0.83 PDK2 (0.47) TYK2JAK2KDM4ECYP2C9RAB9A
SCHEMBL21447016 0.83 TDP1 (0.51) KDM4ERAB9AMAPTABL1NPC1
SCHEMBL28794849 0.83 ABL1 (0.45) TYK2JAK2KDM4ECYP1A2CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11655216-B2 Aryl and heteroaryl ether derivatives as liver X receptor beta agonists, compositions, and their use MERCK SHARP & DOHME LLC (US) 2023-05-23 US disclosed
US-20200247754-A1 ARYL AND HETEROARYL ETHER DERIVATIVES AS LIVER X RECEPTOR BETA AGONISTS, COMPOSITIONS, AND THEIR USE MERCK SHARP & DOHME CORP. (US) 2020-08-06 US disclosed
WO-2018068295-A1 ARYL AND HETEROARYL ETHER DERIVATIVES AS LIVER X RECEPTOR β AGONISTS, COMPOSITIONS, AND THEIR USE MERCK SHARP & DOHME CORP. (US) 2018-04-19 WO disclosed
US-20130045993-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASES AND THEIR USE Piramal Enterprises Limited (IN) 2013-02-21 US disclosed
US-8304449-B2 Inhibitors of cyclin dependent kinases and their use PIRAMAL HEALTHCARE LIMITED (IN) 2012-11-06 US disclosed
CN-1668613-B Flavone derivatives as cyclin dependent kinase inhibitors NICHOLAS PIRAMAL INDIA LTD 2012-07-04 CN disclosed
WO-2012052395-A1 ISOXAZOLE DERIVATIVES USED AS OESTROGEN MODULATORS N. V. ORGANON (NL) 2012-04-26 WO disclosed
US-20110136873-A1 Inhibitors of Cyclin Dependent Kinases and Their Use PIRAMAL LIFE SCIENCES LTD. (IN) 2011-06-09 US disclosed
US-7915301-B2 chromenone derivatives of nitrogen-, oxygen- or sulfur-containing saturated heterocycles; preparation by cyclizing benzoyl intermediates; antiproliferative agents; 2-(2-Chloro-phenyl)-8-(2-hydroxymethyl-1-methyl-pyrrolidin-3-yl)-5,7-dimethoxy-chromen-4-one Piramal Life Science Limited (IN) 2011-03-29 US disclosed
US-7884127-B2 chromenone derivatives of nitrogen-, oxygen- or sulfur-containing saturated heterocycles; preparation by cyclizing benzoyl intermediates; antiproliferative agents; 2-(2-Chloro-phenyl)-8-(2-hydroxymethyl-1-methyl-pyrrolidin-3-yl)-5,7-dimethoxy-chromen-4-one; acidification Pirimal Life Sciences Ltd. (IN) 2011-02-08 US disclosed
US-7045539-B2 Therapeutic benzoxazole compounds ASTRAZENECA AB (SE) 2006-05-16 US disclosed
CN-1678321-A Methods of treating or preventing autoimmune diseases with 2, 4-pyrimidinediamine compounds RIGEL PHARMACEUTICALS INC (US) 2005-10-05 CN disclosed
CN-1668613-A Flavone derivatives as cyclin dependent kinase inhibitors NICHOLAS PIRAMAL INDIA LTD (IN) 2005-09-14 CN disclosed
EP-1556375-A2 FLAVONE DERIVATIVES AS INHIBITORS OF CYCLIN-DEPENDENT KINASES Nicholas Piramal India Limited (IN) 2005-07-27 EP disclosed
US-20040106581-A1 Inhibitors of cyclin-dependent kinases and their use NICHOLAS PIRAMAL INDIA LIMITED (IN) 2004-06-03 US disclosed
US-20040102435-A1 Therapeutic compounds ASTRAZENECA AB (SE) 2004-05-27 US disclosed
WO-2004004632-A2 FLAVONE DERIVATIVES AS INHIBITORS OF CYCLIN-DEPENDENT KINASES NICHOLAS PIRAMAL INDIA LIMITED (IN) 2004-01-15 WO disclosed
EP-1345914-A1 THERAPEUTIC COMPOUNDS AstraZeneca AB (SE) 2003-09-24 EP disclosed
WO-2002051821-A1 THERAPEUTIC COMPOUNDS ASTRAZENECA AB (SE) 2002-07-04 WO disclosed
US-5856574-A ANTIISCHEMIC AGENTS; ANTIARRTHYMIA AGENTS HOECHST AKTIENGESELLSCHAFT (DE) 1999-01-05 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 (6 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-20200247754-A1 ARYL AND HETEROARYL ETHER DERIVATIVES AS LIVER X RECEPTOR BETA AGONISTS, COMPOSITIONS, AND THEIR USE NR1H2, NR1H3, NR1H4 TYK2 1465/4885JAK2 1724/4885KDM4E 1375/4885
US-20040102435-A1 Therapeutic compounds ESRRA, ESRRG, ESR2 TYK2 1494/4885JAK2 969/4885KDM4E 2759/4885
US-20040106581-A1 Inhibitors of cyclin-dependent kinases and their use CCNK, CCNI, CDK1 TYK2 554/4885JAK2 379/4885KDM4E 1718/4885
US-20110136873-A1 Inhibitors of Cyclin Dependent Kinases and Their Use CDK1, CCNK, CCNI TYK2 438/4885JAK2 300/4885KDM4E 1821/4885
US-11655216-B2 Aryl and heteroaryl ether derivatives as liver X receptor beta agonists, compositions, and their use NR1H2, NR1H3, NR1H4 TYK2 1465/4885JAK2 1724/4885KDM4E 1375/4885
US-20130045993-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASES AND THEIR USE CDK1, CCNK, CCNI TYK2 528/4885JAK2 265/4885KDM4E 1474/4885

“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.