SCHEMBL6650962

SCHEMBL6650962

COc1cc(C(=O)c2ccc(N)cc2)cc(OC)c1OC

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TUBB4A P04350 5/20 0.73
TUBB P07437 5/20 0.73
TUBA3C P0DPH7 5/20 0.73
TUBA1B P68363 5/20 0.73
TUBA4A P68366 5/20 0.73
TUBB4B P68371 5/20 0.73
TUBB3 Q13509 5/20 0.73
TUBB2A Q13885 5/20 0.73
TUBB8 Q3ZCM7 5/20 0.73
TUBA3E Q6PEY2 5/20 0.73
TUBA1A Q71U36 5/20 0.73
TUBA1C Q9BQE3 5/20 0.73
TUBB6 Q9BUF5 5/20 0.73
TUBB2B Q9BVA1 5/20 0.73
TUBB1 Q9H4B7 5/20 0.73
CA1 P00915 1/20 0.60
CA2 P00918 1/20 0.60
KRAS P01116 1/20 0.60
SLC22A6 Q4U2R8 1/20 0.56
SLC22A8 Q8TCC7 1/20 0.56

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
SCHEMBL4819729 0.85 TUBB4A (0.75) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL9189645 0.84 TUBB4A (1.00) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL8500772 0.84 CYP1A2 (0.79) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL4823451 0.84 CYP1A2 (0.79) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL13240109 0.83 TUBB1 (1.00) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL1308579 0.83 TUBB4A (0.82) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
Hydrochloric Acid SCHEMBL27888195 0.83 TUBB4A (0.72) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL1308241 0.83 TUBB4A (0.73) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL8626158 0.83 ALDH1A1 (0.64) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL2450750 0.82 TUBB4A (0.72) TUBB4ATUBBTUBA3CTUBA1BTUBA4A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0966424-B1 AMINOBENZOPHENONES AS INHIBITORS OF INTERLEUKIN AND TNF LEO PHARMA AS (DK) 2004-06-23 EP disclosed
US-6313174-B1 FOR THERAPY AND PROPHYLAXIS OF ASTHMA, ALLERGY, RHEUMATOID ARTHRITIS, SPONDYLOARTHRITIS, GOUT, ATHEROSCLEROSIS, CHRONIC INFLAMMATORY BOWEL DISEASE, PROLIFERATIVE AND INFLAMMATORY SKIN DISORDERS Leo Pharmaceutical Products Ltd.A/S/ (Løvens kemiske Fabrik Produktionsaktieselskab) (DK) 2001-11-06 US disclosed
EP-0966424-A1 AMINOBENZOPHENONES AS INHIBITORS OF INTERLEUKIN AND TNF LEO PHARMACEUTICAL PRODUCTS LTD. A/S (LOVENS KEMISKE FABRIK PRODUKTIONSAKTIESELSKAB) (DK) 1999-12-29 EP disclosed
WO-1998032730-A1 AMINOBENZOPHENONES AS INHIBITORS OF INTERLEUKIN AND TNF Leo Pharmaceutical Products Ltd. A/S (Løvens Kemiske Fabrik Produktionsaktieselskab) (DK) 1998-07-30 WO disclosed