SCHEMBL14905366

SCHEMBL14905366

Oc1ccc2ncc(-c3ccncc3)cc2n1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 11/20 0.58
PDGFRA P16234 11/20 0.58
EGFR P00533 2/20 0.58
MAP4K4 O95819 1/20 0.53
CDK8 P49336 1/20 0.53
CLK2 P49760 1/20 0.53
CDK7 P50613 1/20 0.53
CDK9 P50750 1/20 0.53
CDK5 Q00535 1/20 0.53
ACVR1 Q04771 1/20 0.53
ROCK1 Q13464 1/20 0.53
DYRK1A Q13627 1/20 0.53
LRRK2 Q5S007 1/20 0.53
CLK4 Q9HAZ1 1/20 0.53
DYRK1B Q9Y463 1/20 0.53
KDM4E B2RXH2 2/20 0.47
MAPK10 P53779 3/20 0.47
FGFR1 P11362 1/20 0.45
FGFR2 P21802 1/20 0.45
FGFR4 P22455 1/20 0.45

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
SCHEMBL14905530 0.82 PDGFRB (0.61) PDGFRBPDGFRAEGFRCLK4KDM4E
SCHEMBL14905390 0.79 PDGFRB (0.57) PDGFRBPDGFRAEGFRMAP4K4CDK8
SCHEMBL20808354 0.76 PDGFRB (0.49) PDGFRBPDGFRAEGFRMAP4K4CDK8
SCHEMBL14905405 0.76 PDGFRB (0.60) PDGFRBPDGFRAEGFRMAP4K4CDK8
SCHEMBL17247319 0.76 NPC1 (0.49) PDGFRBPDGFRAMAP4K4CDK8CLK2
SCHEMBL17239947 0.76 MAPK1 (0.44) ACVR1LRRK2FGFR1FGFR2FGFR4
SCHEMBL12179667 0.74 PDGFRB (0.59) PDGFRBPDGFRAEGFRMAP4K4CDK8
SCHEMBL31060871 0.74 PDGFRB (1.00) PDGFRBPDGFRAEGFRMAP4K4CDK8
SCHEMBL28268194 0.74 MAP4K4 (0.44) PDGFRBPDGFRAMAP4K4CDK8CLK2
SCHEMBL14905221 0.73 FGFR3 (0.59) FGFR1FGFR2FGFR4FGFR3KDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2776436-B1 NEW COMPOUNDS ASTEX THERAPEUTICS LTD (GB) 2019-03-13 EP disclosed
US-9757364-B2 Naphthyridine derivative compounds ASTEX THERAPEUTICS LTD (GB) 2017-09-12 US disclosed
US-9757364-B2 Naphthyridine derivative compounds ASTEX THERAPEUTICS LTD (GB) 2017-09-12 US disclosed
US-20170105978-A1 NEW COMPOUNDS ASTEX THERAPEUTICS LIMITED (GB) 2017-04-20 US disclosed
US-20170105978-A1 NEW COMPOUNDS ASTEX THERAPEUTICS LIMITED (GB) 2017-04-20 US disclosed
US-9527844-B2 Naphthyridine derivative compounds ASTEX THERAPEUTICS LIMITED (GB) 2016-12-27 US disclosed
US-9527844-B2 Naphthyridine derivative compounds ASTEX THERAPEUTICS LIMITED (GB) 2016-12-27 US disclosed
US-20160108034-A1 NAPHTHYRIDINE DERIVATIVE COMPOUNDS ASTEX THERAPEUTICS LIMITED (GB) 2016-04-21 US disclosed
US-9309241-B2 Naphthyridine derivative compounds ASTEX THERAPEUTICS LTD (GB) 2016-04-12 US disclosed
US-9309241-B2 Naphthyridine derivative compounds ASTEX THERAPEUTICS LTD (GB) 2016-04-12 US disclosed
US-20150057293-A1 NEW COMPOUNDS ASTEX THERAPEUTICS LIMITED (GB) 2015-02-26 US disclosed
US-20150057293-A1 NEW COMPOUNDS ASTEX THERAPEUTICS LIMITED (GB) 2015-02-26 US disclosed
WO-2013061077-A1 NEW COMPOUNDS ASTEX THERAPEUTICS LIMITED (GB) 2013-05-02 WO 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 (3 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-20150057293-A1 NEW COMPOUNDS NQO1, NTPCR, NDC1 PDGFRB 3569/4885PDGFRA 3281/4885EGFR 1182/4885
US-20170105978-A1 NEW COMPOUNDS NQO1, NTPCR, NDC1 PDGFRB 3569/4885PDGFRA 3281/4885EGFR 1182/4885
US-20160108034-A1 NAPHTHYRIDINE DERIVATIVE COMPOUNDS NQO1, NDC1, NTPCR PDGFRB 3222/4885PDGFRA 2879/4885EGFR 1282/4885

“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.