SCHEMBL3786776

SCHEMBL3786776

Nc1ccc(-c2ccccc2OCc2ccccc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.58
RAB9A P51151 2/20 0.58
L3MBTL1 Q9Y468 2/20 0.58
GAA P10253 1/20 0.58
MAOA P21397 1/20 0.58
MAOB P27338 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
RXRA P19793 1/20 0.56
RXRB P28702 1/20 0.56
RXRG P48443 1/20 0.56
MCL1 Q07820 1/20 0.54
NCOA1 Q15788 1/20 0.53
NCOA3 Q9Y6Q9 1/20 0.53
CYP19A1 P11511 1/20 0.52
CYP11B1 P15538 1/20 0.52
CYP11B2 P19099 1/20 0.52
LTA4H P09960 1/20 0.51
MAPK14 Q16539 1/20 0.51
PTGER1 P34995 6/20 0.49
PTGER4 P35408 3/20 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
SCHEMBL3786163 0.89 MAPT (0.53) MAPTRAB9AL3MBTL1GAAMAOA
SCHEMBL201074 0.87 RXRA (0.70) MAPTRAB9AL3MBTL1MAOAMAOB
SCHEMBL3799955 0.87 CYP19A1 (0.68) MAPTRAB9AL3MBTL1GAAMAOA
SCHEMBL3787470 0.87 PTGDR2 (0.57) MAPTRAB9AL3MBTL1GAAMAOA
SCHEMBL2564573 0.85 RXRA (0.59) MAPTRAB9AL3MBTL1MAOBRXRA
SCHEMBL13738963 0.84 RXRA (0.71) MAPTRAB9AL3MBTL1MAOAMAOB
SCHEMBL13740358 0.83 RXRA (0.75) MAPTRAB9AL3MBTL1MAOAMAOB
SCHEMBL10093045 0.83 SYK (0.63) MAPTL3MBTL1MAOBRXRARXRB
SCHEMBL10785009 0.82 RXRA (0.52) MAPTL3MBTL1RXRARXRBRXRG
SCHEMBL3789362 0.82 PTGER1 (0.59) MAPTL3MBTL1MAOAMAOBRXRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100087680-A1 METHOD FOR PRODUCING BIARYL COMPOUND SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2010-04-08 US disclosed
EP-1914221-A1 PROCESS FOR PRODUCING BIARYL COMPOUND Sumitomo Chemical Company, Limited (JP) 2008-04-23 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 (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-20100087680-A1 METHOD FOR PRODUCING BIARYL COMPOUND NISCH, BLVRB, BBOX1 MAPT 3312/4885RAB9A 1357/4885L3MBTL1 3838/4885

“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.