SCHEMBL3789424

SCHEMBL3789424

CC(=O)Oc1cccc(-c2cccc(N)c2)c1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.56
CYP3A4 P08684 1/20 0.56
ADORA2A P29274 1/20 0.53
ACHE P22303 1/20 0.51
MAPT P10636 2/20 0.50
TDP1 Q9NUW8 1/20 0.50
GAA P10253 1/20 0.50
GAPDH P04406 1/20 0.48
MAOA P21397 1/20 0.47
BACE1 P56817 1/20 0.46
ALDH1A1 P00352 1/20 0.46
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
MCL1 Q07820 1/20 0.45
MAOB P27338 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
SCHEMBL3788510 0.90 LMNA (0.48) LMNACYP3A4ADORA2AACHEMAPT
SCHEMBL363290 0.89 CYP3A4 (0.63) LMNACYP3A4ADORA2AACHEALDH1A1
SCHEMBL3781402 0.88 LMNA (0.56) LMNACYP3A4ADORA2AACHEMAPT
SCHEMBL3783548 0.88 LMNA (0.65) LMNACYP3A4MAPTTDP1GAA
SCHEMBL28032593 0.87 LMNA (0.66) LMNACYP3A4ADORA2AACHEMAPT
SCHEMBL27503998 0.85 MKNK1 (0.47) LMNACYP3A4ADORA2AMAPTTDP1
SCHEMBL4446422 0.84 MAPT (0.67) LMNACYP3A4ACHEMAPTTDP1
SCHEMBL3787833 0.83 GAPDH (0.46) LMNACYP3A4ADORA2AACHEMAPT
SCHEMBL3787458 0.83 BACE1 (0.48) LMNACYP3A4ADORA2AACHEMAPT
SCHEMBL4607313 0.82 LMNA (0.71) LMNACYP3A4ACHEMAPTTDP1

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 LMNA 3250/4885CYP3A4 177/4885ADORA2A 2101/4885

“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.