SCHEMBL7020519

SCHEMBL7020519

COc1ccccc1CNc1nccc(-n2cnc3ccccc32)n1

nearest known ligand 0.67

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 14/20 0.67
MKNK2 Q9HBH9 12/20 0.67
LCK P06239 5/20 0.66

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
SCHEMBL7024758 0.90 MKNK1 (0.70) MKNK1MKNK2LCK
SCHEMBL7022907 0.85 LCK (0.70) MKNK1MKNK2LCK
SCHEMBL7020088 0.83 LCK (0.70) MKNK1MKNK2LCK
SCHEMBL7027192 0.83 LCK (0.70) MKNK1MKNK2LCK
SCHEMBL7025386 0.83 LCK (0.70) MKNK1MKNK2LCK
SCHEMBL7024872 0.82 LCK (0.77) MKNK1MKNK2LCK
SCHEMBL7023275 0.82 LCK (0.69) MKNK1MKNK2LCK
SCHEMBL18803629 0.81 MKNK1 (1.00) MKNK1MKNK2LCK
SCHEMBL7020797 0.80 LCK (0.66) MKNK1MKNK2LCK
SCHEMBL7022617 0.80 LCK (1.00) MKNK1MKNK2LCK

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
EP-1206265-B1 SRC KINASE INHIBITOR COMPOUNDS MERCK & CO INC (US) 2003-11-12 EP disclosed
US-6498165-B1 PYRIMIDINE COMPOUNDS; PROPHYLAXIS AND TREATMENT OF SUCH AS IMMUNE DISEASES, HYPERPROLIFERATIVE DISORDERS, CANCER, ANGIOGENSIS, ATHEROSCELEROSIS, GRAFT REJECTION, RHEUMATOID ARTHRITIS, PSORIASIS MERCK & CO., INC. 2002-12-24 US disclosed