SCHEMBL4605395

SCHEMBL4605395

O=Cc1ccccc1-c1oc2ccccc2c1O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NMUR2 Q9GZQ4 2/20 0.49
▸ KMT2A Q03164 7/20 0.46
▸ MEN1 O00255 6/20 0.46
▸ CYP3A4 P08684 6/20 0.46
▸ KDM4E B2RXH2 6/20 0.46
▸ ALDH1A1 P00352 5/20 0.46
▸ HPGD P15428 4/20 0.46
▸ HSD17B10 Q99714 4/20 0.46
▸ TP53 P04637 5/20 0.45
▸ MAPK1 P28482 4/20 0.45
▸ ALOX15 P16050 4/20 0.45
▸ LMNA P02545 3/20 0.45
▸ CA12 O43570 2/20 0.45
▸ CA9 Q16790 2/20 0.45
▸ CA1 P00915 1/20 0.45
▸ CA2 P00918 1/20 0.45
▸ ABCB1 P08183 1/20 0.45
▸ CALM1 P0DP23 1/20 0.45
▸ AR P10275 1/20 0.45
▸ PKM P14618 1/20 0.45

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
SCHEMBL548261 0.80 KDM4E (0.56) NMUR2KMT2AMEN1CYP3A4KDM4E
SCHEMBL5735188 0.76 MAOA (0.44) NMUR2KMT2AMEN1CYP3A4KDM4E
SCHEMBL9079092 0.75 NMUR2 (0.62) NMUR2KMT2AMEN1CYP3A4KDM4E
SCHEMBL19398804 0.73 ALOX5 (0.53) KMT2AMEN1CYP3A4KDM4EALDH1A1
SCHEMBL29002071 0.73 KDM4E (0.50) KMT2AMEN1CYP3A4KDM4EALDH1A1
Hydrochloric Acid SCHEMBL28880727 0.72 KDM4E (0.49) KMT2AMEN1CYP3A4KDM4EALDH1A1
SCHEMBL548379 0.71 KDM4E (0.54) NMUR2KMT2AMEN1CYP3A4KDM4E
SCHEMBL11733201 0.71 KDM4E (0.73) KMT2AMEN1CYP3A4KDM4EALDH1A1
SCHEMBL28568883 0.70 TRIM24 (0.54) KMT2AMEN1ALDH1A1HPGDLMNA
SCHEMBL5246891 0.70 AKR1C3 (0.70) KMT2AMEN1CYP3A4KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1685122-B1 BENZOFURANS AND BENZOTHIOPHENES MERCK PATENT GMBH (DE) 2008-07-09 — — EP claimed
US-7371774-B2 Benzofurans and benzothiophenes MERCK PATENT GMBH (DE) 2008-05-13 — — US claimed
US-20070066680-A1 Benzofurans and benzothiophenes MERCK PATENT GMBH (DE) 2007-03-22 — — US claimed
EP-1685122-A1 BENZOFURANS AND BENZOTHIOPHENES MERCK PATENT GmbH (DE) 2006-08-02 — — EP claimed
WO-2005054226-A1 BENZOFURANS AND BENZOTHIOPHENES MERCK PATENT GMBH (DE) 2005-06-16 — — WO claimed
EP-1685122-B1 BENZOFURANS AND BENZOTHIOPHENES MERCK PATENT GMBH (DE) 2008-07-09 — — EP disclosed
US-7371774-B2 Benzofurans and benzothiophenes MERCK PATENT GMBH (DE) 2008-05-13 — — US disclosed
US-20070066680-A1 Benzofurans and benzothiophenes MERCK PATENT GMBH (DE) 2007-03-22 — — US disclosed
EP-1685122-A1 BENZOFURANS AND BENZOTHIOPHENES MERCK PATENT GmbH (DE) 2006-08-02 — — EP disclosed
WO-2005054226-A1 BENZOFURANS AND BENZOTHIOPHENES MERCK PATENT GMBH (DE) 2005-06-16 — — 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-20070066680-A1 Benzofurans and benzothiophenes INSR, GPR119, IGF1R NMUR2 2341/4885KMT2A 2846/4885MEN1 458/4885

“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.

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