SCHEMBL2137838

SCHEMBL2137838

c1ccc(COc2cccc(-c3ccccc3)c2)cc1

nearest known ligand 0.69

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MRGPRX4 Q96LA9 2/20 0.69
▸ MAOB P27338 4/20 0.65
▸ NR4A2 P43354 2/20 0.64
▸ CYP4F2 P78329 1/20 0.61
▸ CYP4A11 Q02928 1/20 0.61
▸ BCHE P06276 1/20 0.61
▸ MAOA P21397 1/20 0.59
▸ ALOX5 P09917 1/20 0.58
▸ GSTP1 P09211 2/20 0.57
▸ HDAC4 P56524 1/20 0.57
▸ NAAA Q02083 1/20 0.57
▸ SOD1 P00441 1/20 0.57
▸ LCK P06239 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
SCHEMBL379281 0.98 MAOB (0.67) MRGPRX4MAOBNR4A2CYP4F2CYP4A11
SCHEMBL16346074 0.94 GSTP1 (0.66) MRGPRX4MAOBNR4A2CYP4F2CYP4A11
SCHEMBL7346174 0.91 MRGPRX4 (0.64) MRGPRX4MAOBNR4A2CYP4F2CYP4A11
SCHEMBL6099245 0.90 MRGPRX4 (0.58) MRGPRX4MAOBNR4A2CYP4F2CYP4A11
SCHEMBL1956583 0.90 MRGPRX4 (0.58) MRGPRX4MAOBNR4A2CYP4F2CYP4A11
SCHEMBL30426715 0.90 MAOB (0.68) MRGPRX4MAOBNR4A2CYP4F2CYP4A11
SCHEMBL3786472 0.90 MAOB (0.68) MRGPRX4MAOBNR4A2CYP4F2CYP4A11
SCHEMBL2570119 0.90 MAOB (0.65) MRGPRX4MAOBNR4A2CYP4F2CYP4A11
SCHEMBL3687040 0.88 MRGPRX4 (0.57) MRGPRX4MAOBNR4A2CYP4F2CYP4A11
SCHEMBL9405631 0.88 MAOB (0.71) MRGPRX4MAOBNR4A2BCHEGSTP1

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
CN-104478836-B Benzofuran compounds and its preparation, purposes 上海交通大学 2017-06-13 — — CN disclosed
US-8242278-B2 Process for producing biaryl compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-08-14 — — US disclosed
US-20120101278-A1 PROCESS FOR PRODUCING BIARYL COMPOUND HAGIYA KOJI (JP) 2012-04-26 — — US disclosed
EP-1473286-B1 PROCESS FOR PRODUCING BIARYL COMPOUND SUMITOMO CHEMICAL CO (JP) 2009-11-04 — — EP disclosed
US-20090216017-A1 PROCESS FOR PRODUCING BIARYL COMPOUND HAGIYA KOJI 2009-08-27 — — US disclosed
US-7554000-B2 Process for producing biaryl compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-06-30 — — US disclosed
CN-1303043-C Process for producing biaryl compound SUMITOMO CHEMICAL CO (JP) 2007-03-07 — — CN disclosed
CN-1642879-A Process for preparing diaryl compounds SUMITOMO CHEMICAL CO (JP) 2005-07-20 — — CN disclosed
US-20050096471-A1 Process for producing biaryl compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2005-05-05 — — US disclosed
EP-1473286-A1 PROCESS FOR PRODUCING BIARYL COMPOUND Sumitomo Chemical Company, Limited (JP) 2004-11-03 — — EP 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-20120101278-A1 PROCESS FOR PRODUCING BIARYL COMPOUND PPOX, CAT, TYR MRGPRX4 2689/4885MAOB 30/4885NR4A2 2875/4885
US-20090216017-A1 PROCESS FOR PRODUCING BIARYL COMPOUND PPOX, CAT, TYR MRGPRX4 2689/4885MAOB 30/4885NR4A2 2875/4885
US-20050096471-A1 Process for producing biaryl compound PPOX, CAT, TYR MRGPRX4 2689/4885MAOB 30/4885NR4A2 2875/4885

“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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