SCHEMBL7466239

SCHEMBL7466239

COc1ccc(Nc2nccc(-c3cccnc3)n2)cc1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACVR1 Q04771 2/20 0.72
ABL1 P00519 5/20 0.71
PRKCA P17252 4/20 0.71
PRKCD Q05655 3/20 0.71
EGFR P00533 2/20 0.71
MEN1 O00255 4/20 0.68
KMT2A Q03164 4/20 0.68
NPC1 O15118 2/20 0.68
RAB9A P51151 2/20 0.68
CDK5 Q00535 2/20 0.68
PRKD3 O94806 1/20 0.68
PRKCG P05129 1/20 0.68
PRKCB P05771 1/20 0.68
LCK P06239 1/20 0.68
PRKCH P24723 1/20 0.68
PRKCI P41743 1/20 0.68
ZAP70 P43403 1/20 0.68
PRKCE Q02156 1/20 0.68
PRKCQ Q04759 1/20 0.68
PRKCZ Q05513 1/20 0.68

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
SCHEMBL4897346 0.89 ABL1 (0.67) ABL1PRKCAPRKCDEGFRKMT2A
SCHEMBL7474612 0.86 PIK3CG (0.76) ABL1PRKCAPRKCDEGFRMEN1
SCHEMBL7465398 0.85 PIK3CG (0.76) ACVR1MEN1KMT2ANPC1RAB9A
SCHEMBL4903391 0.83 ABL1 (0.66) ABL1PRKCAPRKCDEGFRPRKD3
SCHEMBL6262145 0.83 ABL1 (1.00) ABL1PRKCAPRKCDEGFRNPC1
SCHEMBL3868291 0.82 ABL1 (0.76) ABL1PRKCAPRKCDEGFRMEN1
SCHEMBL7461475 0.82 ABL1 (0.76) ABL1PRKCAPRKCDEGFRMEN1
SCHEMBL10977837 0.82 PIK3CG (0.78) ABL1PRKCAPRKCDEGFRMEN1
SCHEMBL7464205 0.82 ABL1 (0.76) ABL1PRKCAPRKCDEGFRPRKD3
SCHEMBL7476133 0.82 ABL1 (0.76) ABL1PRKCAPRKCDEGFRMEN1

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