SCHEMBL264412

SCHEMBL264412

Cc1c(Nc2ccc(C)c3[nH]ccc23)nc(N)nc1-c1ccc(OCCN2CCCC2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCQ Q04759 6/20 0.45
PRKCD Q05655 6/20 0.45
ADORA2A P29274 8/20 0.41
ADORA1 P30542 6/20 0.41
ACHE P22303 1/20 0.40
MAOB P27338 1/20 0.40
HRH3 Q9Y5N1 5/20 0.40
ADORA2B P29275 2/20 0.40
PRKCB P05771 1/20 0.39
PRKCH P24723 1/20 0.39
PRKCE Q02156 1/20 0.39
SRC P12931 1/20 0.39
ADORA3 P0DMS8 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
ESR1 P03372 1/20 0.39
TP53 P04637 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
MAPT P10636 1/20 0.39

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
SCHEMBL265011 0.92 PRKCQ (0.44) PRKCQPRKCDADORA2AADORA1ACHE
SCHEMBL735412 0.92 PRKCQ (0.44) PRKCQPRKCDADORA2AADORA1ACHE
SCHEMBL266734 0.79 SRC (0.49) ADORA2AADORA1ACHEHRH3ADORA2B
SCHEMBL270408 0.78 JAK3 (0.62) ADORA2AADORA1HRH3PRKCESRC
Hydrochloric Acid SCHEMBL266087 0.77 JAK3 (0.61) ADORA2AADORA1HRH3PRKCESRC
SCHEMBL17915997 0.77 BRD4 (0.45) PRKCQPRKCDADORA2AADORA1HRH3
SCHEMBL265815 0.76 AXL (0.51) ADORA2AADORA1HRH3SRCCYP3A4
SCHEMBL266270 0.75 LTA4H (0.52) ADORA2AADORA1HRH3SRCKDM4E
SCHEMBL265050 0.74 LTA4H (0.48) ADORA2AADORA1ACHEMAOBHRH3
SCHEMBL265183 0.73 BRD4 (0.47) ADORA2AADORA1ACHEMAOBHRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1951684-B1 BI-ARYL META-PYRIMIDINE INHIBITORS OF KINASES TARGEGEN INC (US) 2016-07-13 EP disclosed
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 PRKCQ 1458/4885PRKCD 2020/4885ADORA2A 460/4885
US-20070191405-A1 Bi-aryl meta-pyrimidine inhibitors of kinases JAK2, TYK2, JAK3 PRKCQ 1262/4885PRKCD 1515/4885ADORA2A 646/4885
US-20070259904-A1 Bi-aryl meta-pyrimidine inhibitors of kinases JAK2, TYK2, JAK3 PRKCQ 1262/4885PRKCD 1515/4885ADORA2A 646/4885
US-20090275582-A1 Bi-Aryl Meta-Pyrimidine Inhibitors of Kinases JAK2, TYK2, JAK3 PRKCQ 1262/4885PRKCD 1515/4885ADORA2A 646/4885
US-20110212077-A1 BI-ARYL META-PYRIMIDINE INHIBITORS OF KINASES JAK2, TYK2, JAK3 PRKCQ 1262/4885PRKCD 1515/4885ADORA2A 646/4885

“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.