SCHEMBL311100

SCHEMBL311100

CC(C)(C)OC(=O)N1CCN(CCF)CC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.50
CHRM4 P08173 1/20 0.50
CHRM1 P11229 1/20 0.50
CHRM3 P20309 1/20 0.50
USP2 O75604 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
ACKR3 P25106 1/20 0.44
HPGD P15428 1/20 0.43
EPHX2 P34913 1/20 0.42
TLR8 Q9NR97 1/20 0.42
PLK1 P53350 1/20 0.42
ALDH1A1 P00352 2/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
DTYMK P23919 1/20 0.41
RECQL P46063 1/20 0.41
EPHX1 P07099 1/20 0.41
NPC1 O15118 1/20 0.41
MAPT P10636 1/20 0.41
MAPK1 P28482 1/20 0.41

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
SCHEMBL6486395 0.94 MEN1 (0.47) CHRM2CHRM4CHRM1CHRM3USP2
SCHEMBL8242595 0.89 USP2 (0.61) CHRM2CHRM4CHRM1CHRM3USP2
SCHEMBL6476514 0.89 USP2 (0.46) CHRM2CHRM4CHRM1CHRM3USP2
SCHEMBL12644325 0.86 USP2 (0.50) CHRM2CHRM4CHRM1CHRM3USP2
SCHEMBL46682 0.86 USP2 (0.50) CHRM2CHRM4CHRM1CHRM3USP2
SCHEMBL27340702 0.86 GPR119 (0.52) HPGDRECQLEPHX1
SCHEMBL20873847 0.86 USP2 (0.53) CHRM2CHRM4CHRM1CHRM3USP2
SCHEMBL10318670 0.86 USP2 (0.53) CHRM2CHRM4CHRM1CHRM3USP2
SCHEMBL309857 0.85 HPGD (0.45) CHRM2CHRM4CHRM1CHRM3USP2
Ammonia Solution, Strong SCHEMBL208691 0.85 USP2 (0.49) CHRM2CHRM4CHRM1CHRM3USP2

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 69 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2479165-B1 GLYCINE COMPOUND ASTELLAS PHARMA INC (JP) 2017-10-25 EP disclosed
EP-2552921-B1 PURINE COMPOUNDS LILLY CO ELI (US) 2015-10-07 EP disclosed
EP-2379555-B1 PURINE COMPOUNDS LILLY CO ELI (US) 2015-02-25 EP disclosed
EP-2356113-B1 HETEROCYCLICALLY SUBSTITUTED ARYL COMPOUNDS AS HIF INHIBITORS BAYER IP GMBH (DE) 2015-01-07 EP disclosed
EP-2356113-B1 HETEROCYCLICALLY SUBSTITUTED ARYL COMPOUNDS AS HIF INHIBITORS BAYER IP GMBH (DE) 2015-01-07 EP disclosed
US-8802679-B2 Glycine compound ASTELLAS PHARMA INC. (JP) 2014-08-12 US disclosed
US-8802679-B2 Glycine compound ASTELLAS PHARMA INC. (JP) 2014-08-12 US disclosed
US-8759360-B2 Purine compounds ELI LILLY AND COMPANY (US) 2014-06-24 US disclosed
EP-2552916-B1 PURINE COMPOUNDS USED AS CB2 AGONISTS LILLY CO ELI (US) 2014-05-21 EP disclosed
US-8710063-B2 Purine compounds used as CB2 agonists ELI LILLY AND COMPANY (US) 2014-04-29 US disclosed
US-20050085465-A1 Angiogenesis inhibitor; antiarthritic agents; psoriasis; anticancer agents ASTRAZENECA AB (SE) 2005-04-21 US disclosed
EP-1521751-A1 SUBSTITUTED 3-CYANOQUINOLINES AS MEK INHIBITORS Astrazeneca AB (SE) 2005-04-13 EP disclosed
EP-1474420-A1 QUINAZOLINE COMPOUNDS Astrazeneca AB (SE) 2004-11-10 EP disclosed
WO-2004004732-A1 QUINAZOLINE DERIVATIVES FOR USE IN THE TREATMENT OF CANCER ASTRAZENECA AB (SE) 2004-01-15 WO disclosed
WO-2004005284-A1 SUBSTITUTED 3-CYANOQUINOLINES AS MEK INHIBITORS ASTRAZENECA AB (SE) 2004-01-15 WO disclosed
WO-2003064413-A1 QUINAZOLINE COMPOUNDS ASTRAZENECA AB (SE) 2003-08-07 WO disclosed
WO-2003047583-A1 PHARMACEUTICAL COMPOSITIONS COMPRISING BENZOFURANYL SUBSTITUTED 3-CYANOQUINOLINE DERIVATIVES AND THEIR USE FOR THE TREATMENT OF SOLID TUMOURS ASTRAZENECA AB (SE) 2003-06-12 WO disclosed
WO-2003048159-A1 QUINOLINE DERIVATIVES ASTRAZENECA AB (SE) 2003-06-12 WO disclosed
EP-0815103-A1 TRYPSIN AND THROMBIN INHIBITORS Novartis AG (CH) 1998-01-07 EP disclosed
WO-1996029327-A1 TRYPSIN AND THROMBIN INHIBITORS NOVARTIS AG (CH) 1996-09-26 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-20050085465-A1 Angiogenesis inhibitor; antiarthritic agents; psoriasis; anticancer agents VEGFA, FLT4, FLT1 CHRM2 3872/4885CHRM4 3859/4885CHRM1 2441/4885

“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.