SCHEMBL2143133

SCHEMBL2143133

CC(C)(C)OC(=O)N1CCC2(CC1)CN(C(=O)c1nc3ccccc3s1)CCO2

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 1/20 0.52
▸ GPR119 Q8TDV5 2/20 0.48
▸ RAB9A P51151 2/20 0.47
▸ HPGD P15428 1/20 0.47
▸ SCD5 Q86SK9 1/20 0.43
▸ ALDH1A1 P00352 3/20 0.42
▸ TSHR P16473 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ RBP4 P02753 1/20 0.41
▸ LMNA P02545 3/20 0.41
▸ CHRM2 P08172 2/20 0.40
▸ CHRM3 P20309 2/20 0.40
▸ PIK3CA P42336 2/20 0.40
▸ MTOR P42345 1/20 0.40
▸ MEN1 O00255 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ ATR Q13535 1/20 0.39
▸ NAMPT P43490 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL2139374 0.85 RAB9A (0.53) SMN1; SMN2RAB9AHPGDALDH1A1TSHR
SCHEMBL12101042 0.83 SMN1; SMN2 (0.53) SMN1; SMN2GPR119RAB9AHPGDSCD5
SCHEMBL2140383 0.81 RAB9A (0.53) SMN1; SMN2RAB9AHPGDALDH1A1TSHR
SCHEMBL17328213 0.80 CHRM2 (0.56) SMN1; SMN2GPR119SCD5TSHRCHRM2
SCHEMBL17328261 0.78 EPHX2 (0.58) GPR119SCD5CHRM2CHRM3PIK3CA
SCHEMBL2141658 0.77 HPGD (0.46) SMN1; SMN2RAB9AHPGDALDH1A1TSHR
SCHEMBL2139301 0.77 CHRM2 (0.44) SMN1; SMN2SCD5CHRM2CHRM3PIK3CA
SCHEMBL10241542 0.77 PIK3CA (0.41) SMN1; SMN2HPGDSCD5ALDH1A1CHRM2
SCHEMBL2142176 0.76 CHRM2 (0.54) SCD5CHRM2CHRM3PIK3CAMTOR
SCHEMBL2142232 0.75 EPHX2 (0.42) SMN1; SMN2HPGDSCD5CHRM2CHRM3

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 16 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
EP-2242759-A1 COMPOUNDS AstraZeneca AB (SE) 2010-10-27 — — EP 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
WO-2009098448-A1 COMPOUNDS ASTRAZENECA AB (SE) 2009-08-13 — — WO disclosed
WO-2009098448-A1 COMPOUNDS ASTRAZENECA AB (SE) 2009-08-13 — — 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 (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 SMN1; SMN2 3300/4885GPR119 2048/4885RAB9A 2682/4885
US-20090298807-A1 Compounds PKD1, SLC10A1, ABCB11 SMN1; SMN2 2946/4885GPR119 926/4885RAB9A 1216/4885

“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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