SCHEMBL3786259

SCHEMBL3786259

CC(=O)Oc1ccc(N)c(-c2ccccc2N)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.49
ALDH1A1 P00352 4/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
BACE1 P56817 2/20 0.49
LMNA P02545 3/20 0.46
ELANE P08246 1/20 0.46
CYP3A4 P08684 1/20 0.46
MAPK1 P28482 1/20 0.45
HSP90AA1 P07900 1/20 0.44
GAA P10253 1/20 0.44
NPC1 O15118 2/20 0.43
POLB P06746 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
USP2 O75604 1/20 0.43
HTT P42858 1/20 0.43
KDM4E B2RXH2 2/20 0.42
ACHE P22303 2/20 0.42
FLT3 P36888 1/20 0.42

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
SCHEMBL3786320 0.90 LMNA (0.46) MAPTALDH1A1SMN1; SMN2BACE1LMNA
SCHEMBL3785527 0.85 BACE1 (0.64) MAPTALDH1A1SMN1; SMN2BACE1LMNA
SCHEMBL17744794 0.82 ALDH1A1 (0.48) MAPTALDH1A1SMN1; SMN2LMNACYP3A4
SCHEMBL17744891 0.82 KMT2A (0.50) MAPTALDH1A1POLBL3MBTL1MEN1
SCHEMBL3785193 0.81 ELANE (0.51) MAPTALDH1A1BACE1LMNAELANE
SCHEMBL3793282 0.81 LMNA (0.51) MAPTALDH1A1BACE1LMNACYP3A4
SCHEMBL19084240 0.80 BACE1 (0.56) MAPTALDH1A1SMN1; SMN2BACE1LMNA
SCHEMBL17744818 0.80 KMT2A (0.47) MAPTALDH1A1POLBL3MBTL1MEN1
SCHEMBL3786201 0.80 ALDH1A1 (0.39) MAPTALDH1A1SMN1; SMN2BACE1LMNA
SCHEMBL3786256 0.79 CYP19A1 (0.49) MAPTALDH1A1SMN1; SMN2BACE1LMNA

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 3312/4885ALDH1A1 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.