SCHEMBL3786746

SCHEMBL3786746

COc1ccc(OC(=O)Nc2ccc(-c3ccccc3N)cc2)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 5/20 0.65
ALDH1A1 P00352 5/20 0.65
SMN1; SMN2 Q16637 3/20 0.65
HTT P42858 1/20 0.65
POLB P06746 1/20 0.53
RAB9A P51151 5/20 0.52
NPC1 O15118 4/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
MAPT P10636 3/20 0.50
KDM4E B2RXH2 3/20 0.49
GLA P06280 2/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
THRB P10828 2/20 0.49
GFER P55789 2/20 0.49
TDP1 Q9NUW8 2/20 0.49
LMNA P02545 1/20 0.49
TP53 P04637 1/20 0.49
BLM P54132 1/20 0.49
CASP6 P55212 1/20 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
SCHEMBL3790147 0.86 GAA (0.60) GAAALDH1A1SMN1; SMN2HTTPOLB
SCHEMBL3784624 0.86 ALDH1A1 (0.59) GAAALDH1A1SMN1; SMN2HTTPOLB
SCHEMBL3786389 0.86 ALDH1A1 (0.59) GAAALDH1A1SMN1; SMN2HTTPOLB
SCHEMBL3790992 0.85 GAA (0.56) GAAALDH1A1SMN1; SMN2HTTPOLB
SCHEMBL3788115 0.85 ALDH1A1 (0.62) GAAALDH1A1SMN1; SMN2HTTPOLB
SCHEMBL3789400 0.85 GAA (0.62) GAAALDH1A1SMN1; SMN2HTTPOLB
SCHEMBL3789062 0.84 GAA (0.50) GAAALDH1A1SMN1; SMN2HTTKDM4E
SCHEMBL3791270 0.84 HDAC2 (0.58) GAAALDH1A1SMN1; SMN2HTTMEN1
SCHEMBL3786248 0.82 GAA (0.53) GAAALDH1A1SMN1; SMN2HTTPOLB
SCHEMBL3789275 0.82 GAA (0.53) GAAALDH1A1SMN1; SMN2HTTPOLB

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 GAA 1755/4885ALDH1A1 4339/4885SMN1; SMN2 4524/4885

“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.