SCHEMBL7316232

SCHEMBL7316232

O=C(O)c1ccc(OCCC2CCCCC2)cc1

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 1/20 0.62
MEN1 O00255 1/20 0.58
KMT2A Q03164 1/20 0.58
PKM P14618 1/20 0.56
PARP15 Q460N3 2/20 0.54
PARP10 Q53GL7 2/20 0.54
HPGD P15428 3/20 0.50
MAPK1 P28482 1/20 0.50
TP53 P04637 1/20 0.50
TSHR P16473 1/20 0.50
PLA2G4B P0C869 1/20 0.49
ALDH1A1 P00352 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
GCK P35557 1/20 0.48

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
SCHEMBL9634931 0.92 MEN1 (0.60) NFE2L2MEN1KMT2APKMPARP15
SCHEMBL833819 0.92 PKM (0.61) NFE2L2MEN1KMT2APKMPARP15
SCHEMBL11893183 0.86 NFE2L2 (0.60) NFE2L2MEN1KMT2APARP15PARP10
SCHEMBL7321013 0.86 NFE2L2 (0.60) NFE2L2MEN1KMT2APARP15PARP10
SCHEMBL942949 0.85 MEN1 (0.55) MEN1KMT2APKMMAPK1TP53
SCHEMBL1532841 0.84 PARP10 (0.74) MEN1KMT2APKMPARP15PARP10
SCHEMBL1532862 0.84 PARP10 (0.74) MEN1KMT2APKMPARP15PARP10
SCHEMBL12420700 0.84 PARP10 (0.74) MEN1KMT2APKMPARP15PARP10
SCHEMBL7740744 0.82 NFE2L2 (0.56) NFE2L2MEN1KMT2APARP15PARP10
SCHEMBL2193712 0.82 KMT2A (0.58) NFE2L2KMT2AHPGDPLA2G4BGCK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110172230-A1 UREA COMPOUND OR SALT THEREOF ASTELLAS PHARMA INC. (JP) 2011-07-14 US disclosed
US-20110172230-A1 UREA COMPOUND OR SALT THEREOF ASTELLAS PHARMA INC. (JP) 2011-07-14 US disclosed
EP-2065369-A1 UREA COMPOUND OR SALT THEREOF Astellas Pharma Inc. (JP) 2009-06-03 EP disclosed
EP-0927035-A4 THROMBIN INHIBITORS MERCK & CO INC (US) 2002-11-13 EP disclosed
EP-0927035-A1 THROMBIN INHIBITORS Merck & Co., Inc. (US) 1999-07-07 EP disclosed
US-5872138-A INHIBITING LOSS OF BLOOD PLATELETS, INHIBITING FORMATION OF BLOOD PLATELET AGGREGATES, INHIBITING FORMATION OF FIBRIN, INHIBITING THROMBUS FORMATION, AND INHIBITING EMBOLUS FORMATION IN A MAMMAL MERCK & CO., INC. (US) 1999-02-16 US disclosed
WO-1998010763-A1 THROMBIN INHIBITORS MERCK & CO., INC. (US) 1998-03-19 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 (1 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-20110172230-A1 UREA COMPOUND OR SALT THEREOF FAAH, FAAH2, UTS2R NFE2L2 1770/4885MEN1 4707/4885KMT2A 1156/4885

“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.