SCHEMBL266809

SCHEMBL266809

COc1cc(Nc2nc(N)nc(-c3cccc(OCCN4CCCC4)c3)c2C)c(Cl)cc1Cl

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.42
ADORA2A P29274 4/20 0.42
ADORA1 P30542 4/20 0.42
BACE1 P56817 1/20 0.42
SRC P12931 5/20 0.42
MAP4K4 O95819 1/20 0.42
YES1 P07947 1/20 0.41
MCHR1 Q99705 1/20 0.40
AVPR1B P47901 1/20 0.40
IGF1R P08069 4/20 0.40
INSR P06213 1/20 0.40
ALK Q9UM73 1/20 0.40
ABL1 P00519 1/20 0.39
BCR P11274 1/20 0.39
EPHA2 P29317 1/20 0.39
KDR P35968 1/20 0.39
EPHB4 P54760 1/20 0.39
AXL P30530 1/20 0.38

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
SCHEMBL265050 0.78 LTA4H (0.48) LTA4HADORA2AADORA1BACE1SRC
SCHEMBL263862 0.76 BRD4 (0.56) ADORA2AADORA1SRCYES1IGF1R
SCHEMBL265815 0.75 AXL (0.51) ADORA2AADORA1BACE1SRCYES1
SCHEMBL5469368 0.73 PRKCQ (0.65) SRCABL1BCR
SCHEMBL265051 0.72 SRC (0.52) SRCMAP4K4YES1IGF1RINSR
SCHEMBL30367804 0.72 SRC (0.52) SRCMAP4K4YES1IGF1RINSR
SCHEMBL269990 0.72 SYK (0.48) ADORA2AADORA1SRCYES1IGF1R
SCHEMBL264781 0.72 ADORA2A (0.46) LTA4HADORA2AADORA1SRCYES1
SCHEMBL266734 0.72 SRC (0.49) LTA4HADORA2AADORA1BACE1SRC
SCHEMBL265183 0.72 BRD4 (0.47) LTA4HADORA2AADORA1SRCYES1

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 LTA4H 626/4885ADORA2A 460/4885ADORA1 819/4885
US-20070191405-A1 Bi-aryl meta-pyrimidine inhibitors of kinases JAK2, TYK2, JAK3 LTA4H 3846/4885ADORA2A 646/4885ADORA1 1053/4885
US-20070259904-A1 Bi-aryl meta-pyrimidine inhibitors of kinases JAK2, TYK2, JAK3 LTA4H 3846/4885ADORA2A 646/4885ADORA1 1053/4885
US-20090275582-A1 Bi-Aryl Meta-Pyrimidine Inhibitors of Kinases JAK2, TYK2, JAK3 LTA4H 3846/4885ADORA2A 646/4885ADORA1 1053/4885
US-20110212077-A1 BI-ARYL META-PYRIMIDINE INHIBITORS OF KINASES JAK2, TYK2, JAK3 LTA4H 3846/4885ADORA2A 646/4885ADORA1 1053/4885

“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.