SCHEMBL3786926

SCHEMBL3786926

Nc1cccc(-c2cccc(Oc3ccccc3)c2N)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NCOA1 Q15788 1/20 0.54
NCOA3 Q9Y6Q9 1/20 0.54
MAOB P27338 2/20 0.53
MAOA P21397 2/20 0.48
ADORA2A P29274 1/20 0.44
MAP4K4 O95819 1/20 0.42
SCN9A Q15858 1/20 0.42
BRD4 O60885 1/20 0.42
ADRA2A P08913 1/20 0.40
ADRA2B P18089 1/20 0.40
ADRA2C P18825 1/20 0.40
GRM5 P41594 1/20 0.39
ALDH1A1 P00352 4/20 0.39
CYP3A4 P08684 2/20 0.39
MEN1 O00255 2/20 0.39
MAPT P10636 2/20 0.39
KMT2A Q03164 2/20 0.39
MECP2 P51608 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39

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
SCHEMBL25135238 0.90 MAOB (0.58) NCOA1NCOA3MAOBMAOAADORA2A
SCHEMBL3791439 0.90 NCOA1 (0.67) NCOA1NCOA3MAOBMAOAMAP4K4
SCHEMBL3792074 0.88 NCOA1 (0.62) NCOA1NCOA3MAOBMAOAADORA2A
SCHEMBL3783536 0.83 NCOA1 (0.67) NCOA1NCOA3MAOBMAOAADORA2A
SCHEMBL3784930 0.83 NCOA1 (0.57) NCOA1NCOA3MAOBMAOAMAP4K4
SCHEMBL23045907 0.83 NCOA1 (0.62) NCOA1NCOA3MAOBMAOAADORA2A
SCHEMBL28332123 0.83 NCOA1 (0.57) NCOA1NCOA3MAOBMAOAMAP4K4
SCHEMBL25135230 0.83 NCOA1 (0.77) NCOA1NCOA3MAOBMAOAADORA2A
SCHEMBL3791571 0.82 NCOA1 (0.56) NCOA1NCOA3MAOBMAOAMAP4K4
SCHEMBL6681917 0.81 ADORA2A (0.53) NCOA1NCOA3MAOBMAOAADORA2A

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 NCOA1 2120/4885NCOA3 989/4885MAOB 101/4885

“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.