SCHEMBL2142828

SCHEMBL2142828

Cc1cc(C(=O)N2CCOC3(CCN(C(=O)OC(C)(C)C)CC3)C2)cs1

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 2/20 0.55
▸ MAPK1 P28482 1/20 0.44
▸ ACACB O00763 5/20 0.43
▸ PIK3CA P42336 1/20 0.40
▸ MTOR P42345 1/20 0.40
▸ JAK1 P23458 1/20 0.40
▸ SCD5 Q86SK9 1/20 0.40
▸ CHRM2 P08172 5/20 0.40
▸ CHRM3 P20309 5/20 0.40
▸ USP2 O75604 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.39
▸ NAMPT P43490 1/20 0.38
▸ EPHX2 P34913 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
SCHEMBL2142899 0.85 HPGD (0.61) HPGDMAPK1CHRM2CHRM3NPSR1
SCHEMBL17328213 0.82 CHRM2 (0.56) PIK3CAMTORSCD5CHRM2CHRM3
SCHEMBL12101075 0.81 ACACB (0.53) HPGDMAPK1ACACBSCD5USP2
SCHEMBL2143363 0.81 CHRM2 (0.61) ACACBPIK3CAMTORJAK1SCD5
SCHEMBL2142151 0.81 HPGD (0.58) HPGDMAPK1JAK1CHRM2CHRM3
SCHEMBL10241542 0.80 PIK3CA (0.41) HPGDACACBPIK3CAMTORJAK1
SCHEMBL24803194 0.77 USP2 (0.54) HPGDPIK3CAMTORUSP2SMN1; SMN2
SCHEMBL1246052 0.77 CHRM2 (0.64) ACACBPIK3CAMTORJAK1SCD5
SCHEMBL2139301 0.77 CHRM2 (0.44) ACACBPIK3CAMTORJAK1SCD5
SCHEMBL1247151 0.77 CHRM2 (0.64) PIK3CAMTORJAK1SCD5CHRM2

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
US-8629271-B2 Compounds ASTRAZENECA AB (GB) 2014-01-14 — — US disclosed
US-8629271-B2 Compounds ASTRAZENECA AB (GB) 2014-01-14 — — US disclosed
US-8629271-B2 Compounds ASTRAZENECA AB (GB) 2014-01-14 — — US disclosed
US-20120322788-A1 Compouds PULMAGEN THERAPEUTICS (SYNERGY) LIMITED (GB) 2012-12-20 — — US disclosed
US-20120322788-A1 Compouds PULMAGEN THERAPEUTICS (SYNERGY) LIMITED (GB) 2012-12-20 — — US disclosed
US-20120322788-A1 Compouds PULMAGEN THERAPEUTICS (SYNERGY) LIMITED (GB) 2012-12-20 — — US disclosed
EP-2242759-B1 COMPOUNDS ASTRAZENECA AB (SE) 2012-09-12 — — EP disclosed
US-8148373-B2 Compounds ASTRAZENECA AB (SE) 2012-04-03 — — US disclosed
US-8148373-B2 Compounds ASTRAZENECA AB (SE) 2012-04-03 — — US disclosed
US-8148373-B2 Compounds ASTRAZENECA AB (SE) 2012-04-03 — — US disclosed
US-20090298807-A1 Compounds ASTRAZENECA AB (SE) 2009-12-03 — — US disclosed
US-20090298807-A1 Compounds ASTRAZENECA AB (SE) 2009-12-03 — — US disclosed
US-20090298807-A1 Compounds ASTRAZENECA AB (SE) 2009-12-03 — — 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-20120322788-A1 Compouds PKD1, SBDS, ABCB11 HPGD 87/4885MAPK1 3400/4885ACACB 286/4885
US-20090298807-A1 Compounds PKD1, SLC10A1, ABCB11 HPGD 144/4885MAPK1 2982/4885ACACB 342/4885

“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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