SCHEMBL2558056

SCHEMBL2558056

CC(C)(C)OC(=O)N1CCC(=CC#N)C1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 1/20 0.46
GRM5 P41594 3/20 0.46
ADORA1 P30542 2/20 0.45
NR1H2 P55055 2/20 0.45
USP2 O75604 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CTSK P43235 1/20 0.40
MAPK1 P28482 1/20 0.39
MAPT P10636 3/20 0.39
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
ALDH1A1 P00352 1/20 0.39
KMT2A Q03164 1/20 0.39
CYP3A4 P08684 1/20 0.38
CYP1A2 P05177 1/20 0.38
CACNA1C Q13936 1/20 0.38
SCN5A Q14524 1/20 0.38
GPR119 Q8TDV5 2/20 0.37

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
SCHEMBL30803371 1.00 ESR2 (0.46) ESR2GRM5ADORA1NR1H2USP2
SCHEMBL14954612 1.00 ESR2 (0.46) ESR2GRM5ADORA1NR1H2USP2
SCHEMBL19331833 0.92 MEN1 (0.42) ESR2GRM5ADORA1NR1H2USP2
SCHEMBL21044819 0.92 MEN1 (0.42) ESR2GRM5ADORA1NR1H2USP2
SCHEMBL19331872 0.92 MEN1 (0.42) ESR2GRM5ADORA1NR1H2USP2
SCHEMBL99227 0.91 GRM5 (0.53) ESR2GRM5ADORA1NR1H2USP2
SCHEMBL344121 0.88 USP2 (0.41) ESR2GRM5NR1H2USP2SMN1; SMN2
SCHEMBL20660282 0.86 GRM5 (0.49) ESR2GRM5ADORA1NR1H2USP2
SCHEMBL20660281 0.86 GRM5 (0.49) ESR2GRM5ADORA1NR1H2USP2
SCHEMBL16493969 0.85 ESR2 (0.46) ESR2GRM5ADORA1NR1H2USP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116018138-A Substituted 1H-imidazo [1,2-b ] pyrazole-3-carboxamides as inhibitors of brunauer tyrosine kinase 河南知微生物医药有限公司 2023-04-25 CN disclosed
EP-2558468-B1 5, 7-SUBSTITUTED-IMIDAZO [1,2-C] PYRIMIDINES AS INHIBITORS OF JAK KINASES ARRAY BIOPHARMA INC (US) 2015-04-01 EP disclosed
US-8962596-B2 5,7-substituted-imidazo[1,2-C]pyrimidines as inhibitors of JAK kinases ARRAY BIOPHARMA INC. (US) 2015-02-24 US disclosed
US-20130131039-A1 5,7-SUBSTITUTED-IMIDAZO[1,2-C]PYRIMIDINES AS INHIBITORS OF JAK KINASES ARRAY BIOPHARMA INC. (US) 2013-05-23 US disclosed
EP-2558468-A1 5, 7-SUBSTITUTED-IMIDAZO [1, 2-C]PYRIMIDINES AS INHIBITORS OF JAK KINASES Array Biopharma, Inc. (US) 2013-02-20 EP disclosed
WO-2011130146-A1 5, 7-SUBSTITUTED-IMIDAZO [1, 2-C] PYRIMIDINES AS INHIBITORS OF JAK KINASES ARRAY BIOPHARMA INC. (US) 2011-10-20 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 (1 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-20130131039-A1 5,7-SUBSTITUTED-IMIDAZO[1,2-C]PYRIMIDINES AS INHIBITORS OF JAK KINASES JAK1, JAK3, JAK2 ESR2 2919/4885GRM5 1974/4885ADORA1 827/4885

“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.