Sugi Predict

Sugi Predict / Compounds / SCHEMBL8323305

SCHEMBL8323305

SCHEMBL8323305

Fc1ccc(-c2c(-c3ccnc(Oc4ccccc4)n3)ncn2CCCN2CCOCC2)cc1

nearest known ligand 0.67

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ MAPK13 O15264 20/20 0.67
▸ MAPK12 P53778 20/20 0.67
▸ MAPK11 Q15759 20/20 0.67
▸ MAPK14 Q16539 20/20 0.67

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
SCHEMBL4592699 0.93 MAPK14 (0.78) MAPK13MAPK12MAPK11MAPK14
SCHEMBL4593758 0.89 MAPK13 (0.82) MAPK13MAPK12MAPK11MAPK14
SCHEMBL8318559 0.80 MAPK13 (0.86) MAPK13MAPK12MAPK11MAPK14
SCHEMBL7652404 0.79 MAPK14 (0.57) MAPK13MAPK12MAPK11MAPK14
SCHEMBL4584122 0.78 MAPK14 (0.50) MAPK13MAPK12MAPK11MAPK14
SCHEMBL6487997 0.77 MAPK14 (0.72) MAPK13MAPK12MAPK11MAPK14
SCHEMBL8860476 0.77 MAPK13 (0.86) MAPK13MAPK12MAPK11MAPK14
SCHEMBL8860270 0.76 MAPK13 (1.00) MAPK13MAPK12MAPK11MAPK14
Sb-210313 SCHEMBL4918397 0.76 MAPK13 (1.00) MAPK13MAPK12MAPK11MAPK14
SCHEMBL4915298 0.75 MAPK14 (1.00) MAPK13MAPK12MAPK11MAPK14

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-5864036-A Substituted imidazole compounds SMITHKLINE BEECHAM CORPORATION (US) 1999-01-26 — — US disclosed
US-5756499-A Substituted imidazole compounds SMITHKLINE BEECHAM CORPORATION (US) 1998-05-26 — — US disclosed