SCHEMBL6094414

SCHEMBL6094414

CCOC(=O)CC(=O)c1cc(Cl)ccc1O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.62
MEN1 O00255 5/20 0.62
HPGD P15428 4/20 0.62
LMNA P02545 5/20 0.61
HTT P42858 4/20 0.61
KDM4E B2RXH2 4/20 0.61
MAPT P10636 3/20 0.61
KCNH2 Q12809 2/20 0.61
PLA2G1B P04054 1/20 0.61
XBP1 P17861 1/20 0.61
ALOX12 P18054 1/20 0.61
ATG4B Q9Y4P1 1/20 0.61
SMN1; SMN2 Q16637 3/20 0.57
NPSR1 Q6W5P4 2/20 0.57
RAB9A P51151 3/20 0.56
NPC1 O15118 1/20 0.56
USP2 O75604 1/20 0.56
TP53 P04637 1/20 0.56
ALOX15 P16050 1/20 0.56
MAPK1 P28482 1/20 0.56

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
SCHEMBL2935115 0.87 KMT2A (0.53) KMT2AMEN1HPGDLMNAHTT
SCHEMBL5775638 0.86 ERCC5 (0.58) KMT2AMEN1HPGDLMNAHTT
SCHEMBL405868 0.86 MEN1 (0.52) KMT2AMEN1HPGDLMNAHTT
SCHEMBL6076944 0.85 KMT2A (0.52) KMT2AMEN1HPGDLMNAHTT
SCHEMBL2199535 0.85 MEN1 (0.51) KMT2AMEN1HPGDLMNAHTT
SCHEMBL28675648 0.84 MEN1 (0.56) KMT2AMEN1HPGDLMNAHTT
SCHEMBL29364863 0.83 TDP1 (0.62) KMT2AMEN1HPGDKDM4EMAPT
SCHEMBL953973 0.83 TDP1 (0.62) KMT2AMEN1HPGDKDM4EMAPT
SCHEMBL406034 0.82 LMNA (0.59) KMT2AMEN1HPGDLMNAHTT
SCHEMBL28675651 0.82 HPGD (0.50) KMT2AMEN1HPGDLMNAHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109134444-B 3- (2-furan) -4-hydroxycoumarin compound, preparation method thereof and application thereof in resisting plant fungi 陕西师范大学 2021-07-23 CN disclosed
EP-2448941-B1 PYRAZOLOPYRIMIDINE JAK INHIBITOR COMPOUNDS AND METHODS GENENTECH INC (US) 2017-11-08 EP disclosed
US-7138411-B2 Substituted benzopyran derivatives for the treatment of inflammation G.D. SEARLE & CO. (US) 2006-11-21 US disclosed
US-7109211-B2 Substituted benzopyran derivatives for the treatment of inflammation PHARMACIA CORPORATION (OF PFIZER, INC.) (US) 2006-09-19 US disclosed
US-20050049252-A1 Substituted benzopyran derivatives for the treatment of inflammation G.D. SEARLE & CO. (US) 2005-03-03 US disclosed
US-6806288-B1 CYCLOOXYGENASE-2 MEDIATED DISORDERS; REDUCES INFLAMMATION; FEWER SIDE EFFECTS G.D. SEARLE & CO. 2004-10-19 US disclosed
US-20040038977-A1 Substituted bezopyran derivatives for the treatment of inflammation G.D. SEARLE & CO. 2004-02-26 US disclosed
EP-0977748-B1 SUBSTITUTED BENZOPYRAN DERIVATIVES FOR THE TREATMENT OF INFLAMMATION SEARLE & CO (US) 2003-03-26 EP disclosed
US-6492390-B2 TREATING CYCLOOXYGENASE-2 MEDIATED DISORDERS. G.D. SEARLE & CO. 2002-12-10 US disclosed
US-20020010206-A1 Substituted benzopyran analogs for the treatment of inflammation G.D. SEARLE & CO. (US) 2002-01-24 US disclosed
EP-1123285-A1 SUBSTITUTED BENZOPYRAN ANALOGS FOR THE TREATMENT OF INFLAMMATION G.D. SEARLE & CO. (US) 2001-08-16 EP disclosed
US-6271253-B1 CYCLOOXYGENASE INHIBITORS G.D. SEARLE & CO. 2001-08-07 US disclosed
US-6077850-A USEFUL FOR TREATING CYCLOOXYGENASE-2 MEDIATED DISORDERS, SUCH AS INFLAMMATION AND INFLAMMATION-RELATED DISORDERS G.D. SEARLE & CO. (US) 2000-06-20 US disclosed
WO-2000023433-A1 SUBSTITUTED BENZOPYRAN ANALOGS FOR THE TREATMENT OF INFLAMMATION G.D. SEARLE & CO. (US) 2000-04-27 WO disclosed
US-6034256-A CYCLOOXYGEASE INHIBITOR G.D. SEARLE & CO. (US) 2000-03-07 US disclosed
EP-0977748-A1 SUBSTITUTED BENZOPYRAN DERIVATIVES FOR THE TREATMENT OF INFLAMMATION G.D. SEARLE & CO. (US) 2000-02-09 EP disclosed
WO-1998047890-A1 SUBSTITUTED BENZOPYRAN DERIVATIVES FOR THE TREATMENT OF INFLAMMATION G.D. SEARLE & CO. (US) 1998-10-29 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 (3 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-20020010206-A1 Substituted benzopyran analogs for the treatment of inflammation PTGS1, IL1R1, PTGES2 KMT2A 3828/4885MEN1 4337/4885HPGD 78/4885
US-20040038977-A1 Substituted bezopyran derivatives for the treatment of inflammation PTGS1, PTGES2, IL1R1 KMT2A 2680/4885MEN1 4565/4885HPGD 325/4885
US-20050049252-A1 Substituted benzopyran derivatives for the treatment of inflammation PTGES2, PTGS2, PTGER2 KMT2A 3314/4885MEN1 4770/4885HPGD 242/4885

“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.