SCHEMBL263966

SCHEMBL263966

Cc1c(N)nc(Nc2ccc(OCCN3CCCC3)cc2)nc1-c1csc2ccccc12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AXL P30530 8/20 0.51
INSR P06213 4/20 0.51
BACE1 P56817 8/20 0.50
SRC P12931 7/20 0.47
YES1 P07947 2/20 0.45
KDR P35968 2/20 0.45
EPHB4 P54760 2/20 0.45
ABL1 P00519 1/20 0.44
EGFR P00533 1/20 0.44
RAF1 P04049 1/20 0.44
LCK P06239 1/20 0.44
FYN P06241 1/20 0.44
LYN P07948 1/20 0.44
CYP3A4 P08684 1/20 0.44
PDGFRB P09619 1/20 0.44
CYP2D6 P10635 1/20 0.44
FGFR1 P11362 1/20 0.44
RPS6KB1 P23443 1/20 0.44
CYP2C19 P33261 1/20 0.44
CSK P41240 1/20 0.44

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
SCHEMBL4515581 0.79 SRC (0.53) AXLINSRBACE1SRCYES1
SCHEMBL265396 0.78 AXL (0.51) AXLINSRBACE1SRCYES1
SCHEMBL264049 0.78 AXL (0.58) AXLINSRBACE1SRCYES1
SCHEMBL266000 0.77 SRC (0.50) AXLINSRBACE1SRCYES1
SCHEMBL264617 0.77 AXL (0.57) AXLINSRBACE1SRCYES1
SCHEMBL264327 0.76 AXL (0.62) AXLBACE1SRCYES1KDR
SCHEMBL264880 0.75 AXL (0.52) AXLBACE1SRCYES1KDR
SCHEMBL264253 0.75 JAK1 (0.60) AXLINSRBACE1SRCYES1
SCHEMBL264602 0.73 KCNH2 (0.52) AXLBACE1SRCYES1KDR
SCHEMBL265091 0.73 AXL (0.64) AXLBACE1SRCYES1KDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8604042-B2 Bi-aryl meta-pyrimidine inhibitors of kinases TARGEGEN, INC. (US) 2013-12-10 US disclosed
US-8138199-B2 Use of bi-aryl meta-pyrimidine inhibitors of kinases TARGEGEN, INC. (US) 2012-03-20 US disclosed
US-8133900-B2 Use of bi-aryl meta-pyrimidine inhibitors of kinases TARGEGEN, INC. (US) 2012-03-13 US disclosed
US-20110212077-A1 BI-ARYL META-PYRIMIDINE INHIBITORS OF KINASES TARGEGEN, INC. (US) 2011-09-01 US disclosed
US-7825246-B2 Bi-aryl meta-pyrimidine inhibitors of kinases TARGEGEN, INC. (US) 2010-11-02 US disclosed
US-20090286789-A1 Bi-Aryl Meta-Pyrimidine Inhibitors of Kinases TARGEGEN, INC. (US) 2009-11-19 US disclosed
US-20090275582-A1 Bi-Aryl Meta-Pyrimidine Inhibitors of Kinases IMPACT BIOMEDICINES, INC. 2009-11-05 US disclosed
US-7528143-B2 Bi-aryl meta-pyrimidine inhibitors of kinases TARGEGEN, INC. (US) 2009-05-05 US disclosed
US-20070259904-A1 Bi-aryl meta-pyrimidine inhibitors of kinases TARGEGEN, INC. (US) 2007-11-08 US disclosed
US-20070191405-A1 Bi-aryl meta-pyrimidine inhibitors of kinases TARGEGEN, INC. (US) 2007-08-16 US 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 (5 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-20090286789-A1 Bi-Aryl Meta-Pyrimidine Inhibitors of Kinases JAK2, TYK2, LTK AXL 376/4885INSR 1628/4885BACE1 4487/4885
US-20070191405-A1 Bi-aryl meta-pyrimidine inhibitors of kinases JAK2, TYK2, JAK3 AXL 267/4885INSR 870/4885BACE1 4739/4885
US-20070259904-A1 Bi-aryl meta-pyrimidine inhibitors of kinases JAK2, TYK2, JAK3 AXL 267/4885INSR 870/4885BACE1 4739/4885
US-20090275582-A1 Bi-Aryl Meta-Pyrimidine Inhibitors of Kinases JAK2, TYK2, JAK3 AXL 267/4885INSR 870/4885BACE1 4739/4885
US-20110212077-A1 BI-ARYL META-PYRIMIDINE INHIBITORS OF KINASES JAK2, TYK2, JAK3 AXL 267/4885INSR 870/4885BACE1 4739/4885

“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.