SCHEMBL3494604

SCHEMBL3494604

Cc1cnc(Nc2ccc(N3CCN(C)CC3)c(Cl)c2)nc1NC1CC(C)(C)N(C)C(C)(C)C1

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 14/20 0.56
SYK P43405 2/20 0.50
AXL P30530 2/20 0.50
TNK2 Q07912 1/20 0.50
JAK1 P23458 1/20 0.49
JAK3 P52333 1/20 0.49
BRDT Q58F21 1/20 0.49
FLT3 P36888 1/20 0.47

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
SCHEMBL3496816 0.93 TNK2 (0.51) BRD4SYKTNK2JAK3FLT3
SCHEMBL1743511 0.90 BRD4 (0.52) BRD4SYKAXLTNK2JAK1
SCHEMBL3495623 0.88 BRD4 (0.59) BRD4JAK1JAK3BRDTFLT3
SCHEMBL1743517 0.88 PAK1 (0.49) BRD4SYKTNK2JAK3FLT3
SCHEMBL3494581 0.88 BRD4 (0.53) BRD4SYKFLT3
SCHEMBL3494277 0.86 BRD4 (0.53) BRD4SYKTNK2JAK3FLT3
SCHEMBL3495176 0.86 SYK (0.70) SYK
SCHEMBL3494050 0.85 TNK2 (0.62) BRD4SYKAXLTNK2JAK1
SCHEMBL3494544 0.85 BRD4 (0.58) BRD4SYKJAK3
SCHEMBL3496551 0.84 PAK1 (0.57) BRD4TNK2JAK3FLT3

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 BRD4 1173/4885SYK 460/4885AXL 1801/4885

“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.