SCHEMBL3496523

SCHEMBL3496523

COc1ccc(Nc2ncc(Cl)c(NC3CC(C)(C)N(C)C(C)(C)C3)n2)cc1Cl

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
STK17B O94768 1/20 0.54
STK17A Q9UEE5 1/20 0.54
BCL6 P41182 4/20 0.54
BRD4 O60885 7/20 0.52
PRKCQ Q04759 1/20 0.49
ALK Q9UM73 2/20 0.47
INSR P06213 1/20 0.47
ULK1 O75385 1/20 0.47
ULK2 Q8IYT8 1/20 0.47
FLT3 P36888 1/20 0.47
EPHB4 P54760 1/20 0.46
GAA P10253 1/20 0.46
MAPT P10636 1/20 0.46
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45

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
SCHEMBL3496651 0.92 BCL6 (0.52) STK17BSTK17ABCL6BRD4PRKCQ
SCHEMBL3495051 0.92 BCL6 (0.63) STK17BSTK17ABCL6BRD4PRKCQ
SCHEMBL3497130 0.89 ULK1 (0.64) BCL6BRD4PRKCQULK1ULK2
SCHEMBL3496354 0.89 BCL6 (0.49) STK17BSTK17ABCL6BRD4PRKCQ
SCHEMBL3496408 0.88 BRD4 (0.51) STK17BSTK17ABCL6BRD4PRKCQ
SCHEMBL3495615 0.88 SYK (0.55)
SCHEMBL3496521 0.88 BCL6 (0.48) STK17BSTK17ABCL6BRD4PRKCQ
SCHEMBL3497111 0.86 BCL6 (0.61) STK17BSTK17ABCL6PRKCQULK1
SCHEMBL3495607 0.85 PRKCQ (0.59) BRD4PRKCQALKINSRULK1
SCHEMBL3495622 0.85 BRD4 (0.56) STK17BSTK17ABCL6BRD4PRKCQ

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100130486-A1 CYCLIC AMINE SUBSTITUTED PYRIMIDINEDIAMINES AS PKC INHIBITORS RIGEL PHARMACEUTICALS, INC. 2010-05-27 US claimed
EP-2183225-A1 CYCLIC AMINE SUBSTITUTED PYRIMIDINEDIAMINES AS PKC INHIBITORS Rigel Pharmaceuticals, Inc. (US) 2010-05-12 EP claimed
WO-2009012421-A1 CYCLIC AMINE SUBSTITUTED PYRIMIDINEDIAMINES AS PKC INHIBITORS RIGEL PHARMACEUTICALS, INC. (US) 2009-01-22 WO claimed
US-8993585-B2 Cyclic amine substituted pyrimidinediamines as PKC inhibitors RIGEL PHARMACEUTICALS, INC. (US) 2015-03-31 US disclosed
US-20100130486-A1 CYCLIC AMINE SUBSTITUTED PYRIMIDINEDIAMINES AS PKC INHIBITORS RIGEL PHARMACEUTICALS, INC. 2010-05-27 US disclosed
EP-2183225-A1 CYCLIC AMINE SUBSTITUTED PYRIMIDINEDIAMINES AS PKC INHIBITORS Rigel Pharmaceuticals, Inc. (US) 2010-05-12 EP disclosed
WO-2009012421-A1 CYCLIC AMINE SUBSTITUTED PYRIMIDINEDIAMINES AS PKC INHIBITORS RIGEL PHARMACEUTICALS, INC. (US) 2009-01-22 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100130486-A1 CYCLIC AMINE SUBSTITUTED PYRIMIDINEDIAMINES AS PKC INHIBITORS PRKCH, PKD2, PRKCQ STK17B 108/4885STK17A 117/4885BCL6 3211/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.