SCHEMBL265011

SCHEMBL265011

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

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PRKCQ Q04759 6/20 0.44
PRKCD Q05655 6/20 0.44
ADORA2A P29274 9/20 0.43
ADORA1 P30542 7/20 0.43
AXL P30530 1/20 0.42
ACHE P22303 1/20 0.39
MAOB P27338 1/20 0.39
HRH3 Q9Y5N1 5/20 0.39
ADORA2B P29275 2/20 0.39
PRKCB P05771 1/20 0.39
PRKCH P24723 1/20 0.39
PRKCE Q02156 1/20 0.39
ADORA3 P0DMS8 1/20 0.38
SRC P12931 1/20 0.38
BACE1 P56817 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
SCHEMBL264412 0.92 PRKCQ (0.45) PRKCQPRKCDADORA2AADORA1ACHE
SCHEMBL735412 0.90 PRKCQ (0.44) PRKCQPRKCDADORA2AADORA1AXL
SCHEMBL270704 0.78 JAK1 (0.57) ADORA2AADORA1AXLHRH3PRKCE
Hydrochloric Acid SCHEMBL264329 0.77 JAK1 (0.57) ADORA2AADORA1AXLHRH3PRKCE
SCHEMBL266734 0.77 SRC (0.49) ADORA2AADORA1AXLACHEHRH3
SCHEMBL266270 0.75 LTA4H (0.52) ADORA2AADORA1AXLHRH3SRC
SCHEMBL265050 0.73 LTA4H (0.48) ADORA2AADORA1AXLACHEMAOB
SCHEMBL265815 0.73 AXL (0.51) ADORA2AADORA1AXLHRH3SRC
SCHEMBL267158 0.73 SLC2A1 (0.51) ADORA2AADORA1AXLACHEMAOB
SCHEMBL264781 0.72 ADORA2A (0.46) ADORA2AADORA1AXLACHEMAOB

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
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-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.