SCHEMBL14021032

SCHEMBL14021032

Cc1ccc(NC(=O)c2ccc(Nc3nccc(-c4ccc(Cl)cc4)n3)cc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PDGFRA P16234 4/20 0.62
▸ ABL1 P00519 3/20 0.62
▸ PDGFRB P09619 3/20 0.62
▸ BCR P11274 3/20 0.62
▸ PIK3CG P48736 3/20 0.58
▸ PIK3CA P42336 2/20 0.58
▸ PIK3CB P42338 2/20 0.58
▸ JAK2 O60674 4/20 0.58
▸ CAMK2D Q13557 4/20 0.57
▸ JAK3 P52333 1/20 0.57
▸ IKBKB O14920 1/20 0.56
▸ TRPV1 Q8NER1 1/20 0.53
▸ KIT P10721 1/20 0.52
▸ MAPK8 P45983 1/20 0.52
▸ MAPK10 P53779 1/20 0.52

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
SCHEMBL14021028 0.94 PIK3CA (0.64) PDGFRAABL1PDGFRBBCRPIK3CG
SCHEMBL14021026 0.91 PDGFRB (0.63) PDGFRAABL1PDGFRBBCRPIK3CG
SCHEMBL14021038 0.90 CAMK2D (0.71) PDGFRAABL1PDGFRBBCRPIK3CG
SCHEMBL14021033 0.90 AURKA (0.62) PDGFRAABL1PDGFRBBCRPIK3CG
SCHEMBL14021027 0.90 CAMK2D (0.67) PDGFRAABL1PDGFRBBCRPIK3CG
SCHEMBL14021025 0.89 PDGFRA (0.58) PDGFRAABL1PDGFRBBCRPIK3CG
SCHEMBL4905540 0.89 ABL1 (0.62) PDGFRAABL1PDGFRBBCRPIK3CG
SCHEMBL14021041 0.88 ABL1 (0.57) PDGFRAABL1PDGFRBBCRPIK3CG
SCHEMBL14021154 0.86 JAK2 (0.55) PDGFRAABL1PDGFRBBCRPIK3CG
SCHEMBL14021176 0.86 ABL1 (0.55) PDGFRAABL1PDGFRBBCRPIK3CG

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
US-7442699-B2 Anilinopyrimidine derivatives as IKK inhibitors and compositions and methods related thereto SIGNAL PHARMACEUTICALS, LLC (US) 2008-10-28 — — US disclosed
US-7442699-B2 Anilinopyrimidine derivatives as IKK inhibitors and compositions and methods related thereto SIGNAL PHARMACEUTICALS, LLC (US) 2008-10-28 — — US disclosed
US-7429599-B2 Methods for treating or preventing an inflammatory or metabolic condition or inhibiting JNK SIGNAL PHARMACEUTICALS, LLC (US) 2008-09-30 — — US disclosed
US-7429599-B2 Methods for treating or preventing an inflammatory or metabolic condition or inhibiting JNK SIGNAL PHARMACEUTICALS, LLC (US) 2008-09-30 — — US disclosed
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