SCHEMBL264908

SCHEMBL264908

Cc1cnc(Nc2ccc(OCCN3CCCC3)cc2)nc1Cc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 2/20 0.59
JAK1 P23458 6/20 0.58
JAK2 O60674 6/20 0.58
JAK3 P52333 6/20 0.58
BRD4 O60885 5/20 0.58
TYK2 P29597 3/20 0.58
HDAC1 Q13547 3/20 0.58
RET P07949 2/20 0.58
FLT3 P36888 2/20 0.58
HDAC8 Q9BY41 1/20 0.58
HDAC6 Q9UBN7 1/20 0.58
LTA4H P09960 6/20 0.56
YES1 P07947 2/20 0.55
SRC P12931 2/20 0.55
KDR P35968 2/20 0.55
EPHB4 P54760 2/20 0.55
AXL P30530 3/20 0.55
BRDT Q58F21 2/20 0.55
MERTK Q12866 2/20 0.55
PTK2 Q05397 2/20 0.55

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
SCHEMBL265437 0.85 JAK3 (0.74) HRH3JAK1JAK2JAK3BRD4
SCHEMBL21480947 0.84 HRH3 (0.67) HRH3JAK1JAK2JAK3BRD4
SCHEMBL21480940 0.83 HRH3 (0.69) HRH3JAK1JAK2JAK3BRD4
SCHEMBL19629735 0.83 JAK2 (0.76) HRH3JAK1JAK2JAK3BRD4
SCHEMBL21460556 0.83 JAK3 (0.61) HRH3JAK1JAK2JAK3BRD4
SCHEMBL12278161 0.82 JAK1 (0.71) HRH3JAK1JAK2JAK3BRD4
SCHEMBL21460558 0.82 JAK3 (0.60) HRH3JAK1JAK2JAK3BRD4
SCHEMBL3963144 0.81 AXL (0.68) HRH3JAK1JAK2JAK3BRD4
SCHEMBL3968637 0.81 JAK1 (0.69) HRH3JAK1JAK2JAK3BRD4
SCHEMBL270422 0.81 JAK1 (0.63) HRH3JAK1JAK2JAK3BRD4

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 HRH3 93/4885JAK1 6/4885JAK2 1/4885
US-20070191405-A1 Bi-aryl meta-pyrimidine inhibitors of kinases JAK2, TYK2, JAK3 HRH3 1487/4885JAK1 4/4885JAK2 1/4885
US-20070259904-A1 Bi-aryl meta-pyrimidine inhibitors of kinases JAK2, TYK2, JAK3 HRH3 1487/4885JAK1 4/4885JAK2 1/4885
US-20090275582-A1 Bi-Aryl Meta-Pyrimidine Inhibitors of Kinases JAK2, TYK2, JAK3 HRH3 1487/4885JAK1 4/4885JAK2 1/4885
US-20110212077-A1 BI-ARYL META-PYRIMIDINE INHIBITORS OF KINASES JAK2, TYK2, JAK3 HRH3 1487/4885JAK1 4/4885JAK2 1/4885

“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.