SCHEMBL2453854

SCHEMBL2453854

Cc1nc(C)c2c(n1)NC(=O)C2

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ SRC P12931 1/20 0.56
▸ PDE3B Q13370 1/20 0.36
▸ PDE3A Q14432 1/20 0.36
▸ MB P02144 2/20 0.34
▸ HPGD P15428 1/20 0.33
▸ CMA1 P23946 1/20 0.32
▸ AHR P35869 1/20 0.32

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
SCHEMBL4764114 0.82 SRC (0.42) SRCPDE3BPDE3AMB
SCHEMBL29319840 0.81 SRC (0.53) SRCPDE3BPDE3AMBHPGD
SCHEMBL22061405 0.78 SRC (0.46) SRCPDE3BPDE3A
SCHEMBL18103980 0.72 SRC (1.00) SRCPDE3BPDE3AMBHPGD
SCHEMBL12382071 0.71 SRC (0.46) SRCPDE3BPDE3AMBHPGD
SCHEMBL13424558 0.68 MEN1 (0.42) SRCPDE3BPDE3A
SCHEMBL25326789 0.67 CRBN (0.44) SRC
SCHEMBL4044760 0.65 PDE3B (0.48) SRCPDE3BPDE3AAHR
SCHEMBL21372009 0.64 SRC (0.40) SRCPDE3BPDE3AMB
SCHEMBL17926499 0.64 SRC (0.43) SRCCMA1AHR

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-2594270-A2 The use of sGC stimulators, sGC activators, alone and combinations with PDE5 inhibitors for the treatment of systemic sclerosis (SSc) BIP Patents (DE) 2013-05-22 — — EP claimed
US-20110218202-A1 SOLUBLE GUANYLATE CYCLASE ACTIVATORS MERCK SHARP & DOHME CORP. 2011-09-08 — — US claimed
US-9688699-B2 3-(pyrimidine-2-yl)imidazo[1,2-a]pyridines BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2017-06-27 — — US disclosed
EP-3107920-A1 3-(PYRIMIDINE-2-YL)IMIDAZO[1,2-A]PYRIDINES Bayer Pharma Aktiengesellschaft (DE) 2016-12-28 — — EP disclosed
EP-2373317-B1 4-amino-5,7-dihydro-6H-pyrrolo[2,3-d]pyrimidin-6-one or 4-amino-5,8-dihydropyrido[2,3-d]pyrimidin-7(6H)-one derivatives as activators of the soluble guanylat cyclase for the treatment of cardiovascular diseases MERCK SHARP & DOHME (US) 2016-12-14 — — EP disclosed
US-20160347770-A1 3-(PYRIMIDINE-2-YL)IMIDAZO[1,2-A]PYRIDINES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2016-12-01 — — US disclosed
WO-2015124544-A1 3-(PYRIMIDINE-2-YL)IMIDAZO[1,2-A]PYRIDINES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2015-08-27 — — WO disclosed
US-8741910-B2 Soluble guanylate cyclase activators MERCK SHARP & DOHME CORP. (US) 2014-06-03 — — US disclosed
EP-2594270-A2 The use of sGC stimulators, sGC activators, alone and combinations with PDE5 inhibitors for the treatment of systemic sclerosis (SSc) BIP Patents (DE) 2013-05-22 — — EP disclosed
US-20110218202-A1 SOLUBLE GUANYLATE CYCLASE ACTIVATORS MERCK SHARP & DOHME CORP. 2011-09-08 — — 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 (2 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-20110218202-A1 SOLUBLE GUANYLATE CYCLASE ACTIVATORS PDE2A, GUCY1A2, PDE3A SRC 3162/4885PDE3B 4/4885PDE3A 3/4885
US-20160347770-A1 3-(PYRIMIDINE-2-YL)IMIDAZO[1,2-A]PYRIDINES TPMT, PNPO, PDXK SRC 2720/4885PDE3B 277/4885PDE3A 129/4885

“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.

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