SCHEMBL7470849

SCHEMBL7470849

O=C(Cl)c1ccc(Nc2nccc(-c3cccnc3)n2)cc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 16/20 0.69
PRKCA P17252 6/20 0.69
PRKCD Q05655 5/20 0.69
EGFR P00533 2/20 0.69
HDAC1 Q13547 1/20 0.64
BCR P11274 15/20 0.63
MAPK8 P45983 1/20 0.62
MAPK10 P53779 1/20 0.62
PDGFRB P09619 8/20 0.60
PDGFRA P16234 8/20 0.60
SRC P12931 6/20 0.60
PRKD3 O94806 1/20 0.58
PRKCG P05129 1/20 0.58
PRKCB P05771 1/20 0.58
PRKCH P24723 1/20 0.58
PRKCI P41743 1/20 0.58
PRKCE Q02156 1/20 0.58
PRKCQ Q04759 1/20 0.58
PRKCZ Q05513 1/20 0.58
PRKD1 Q15139 1/20 0.58

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
SCHEMBL210190 0.88 ABL1 (0.76) ABL1PRKCAPRKCDEGFRHDAC1
SCHEMBL4903328 0.87 MAPK8 (0.81) ABL1PRKCAPRKCDEGFRHDAC1
SCHEMBL7467179 0.87 ABL1 (0.69) ABL1PRKCAPRKCDEGFRHDAC1
Hydrochloric Acid SCHEMBL7470853 0.87 ABL1 (0.74) ABL1PRKCAPRKCDEGFRHDAC1
SCHEMBL14088818 0.86 ABL1 (0.80) ABL1PRKCAPRKCDEGFRBCR
SCHEMBL7474316 0.85 HDAC1 (0.68) ABL1PRKCAPRKCDEGFRHDAC1
SCHEMBL7464205 0.84 ABL1 (0.76) ABL1PRKCAPRKCDEGFRHDAC1
SCHEMBL4905733 0.83 PDGFRA (0.77) ABL1PRKCAPRKCDEGFRHDAC1
SCHEMBL1566674 0.83 ABL1 (0.69) ABL1PRKCAEGFRBCRPDGFRB
SCHEMBL4901659 0.82 ABL1 (0.81) ABL1PRKCAPRKCDEGFRHDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0233461-B2 4,5,6-Substituted-2-pyrimidinamines AMERICAN CYANAMID CO (US) 2002-05-29 EP disclosed
EP-0233461-B1 4,5,6-Substituted-2-pyrimidinamines AMERICAN CYANAMID CO (US) 1996-03-20 EP disclosed
US-4876252-A ADMINISTERING ANTIASTHMATIC OR ANTIALLERGEN AMERICAN CYANAMID COMPANY (US) 1989-10-24 US disclosed
US-4788195-A TREATING ASTHMA, ALLERGIC DISEASES, INFLAMMATION AND DIABETES IN MAMMALS AMERICAN CYANAMID COMPANY (US) 1988-11-29 US disclosed
EP-0233461-A2 4,5,6-Substituted-2-pyrimidinamines AMERICAN CYANAMID COMPANY (US) 1987-08-26 EP disclosed