SCHEMBL16210205

SCHEMBL16210205

CC(C)(C)OC(=O)N1CCc2noc(C3CC3)c2C1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.40
ESR2 Q92731 1/20 0.40
ADORA1 P30542 1/20 0.40
NR1H2 P55055 1/20 0.39
USP2 O75604 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
C5AR1 P21730 1/20 0.38
DDB1 Q16531 1/20 0.38
CRBN Q96SW2 1/20 0.38
GPR119 Q8TDV5 4/20 0.37
RECQL P46063 1/20 0.37
F12 P00748 1/20 0.37
MTOR P42345 1/20 0.37
KDM4E B2RXH2 1/20 0.37
THRB P10828 1/20 0.37
USP30 Q70CQ3 1/20 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
SCHEMBL16217171 0.82 MAPT (0.43) MAPTESR2ADORA1NR1H2USP2
SCHEMBL16220618 0.82 MAPT (0.43) MAPTESR2ADORA1NR1H2USP2
SCHEMBL16579807 0.81 MAPT (0.42) MAPTESR2ADORA1NR1H2USP2
SCHEMBL22438832 0.81 ADORA1 (0.47) MAPTESR2ADORA1NR1H2USP2
SCHEMBL20424298 0.79 DPP4 (0.46) MAPTESR2ADORA1NR1H2USP2
SCHEMBL22438669 0.78 MAPT (0.43) MAPTESR2ADORA1NR1H2USP2
SCHEMBL16210219 0.76 C5AR1 (0.41) MAPTESR2ADORA1NR1H2C5AR1
SCHEMBL22615303 0.75 ADORA1 (0.51) MAPTESR2ADORA1NR1H2SMN1; SMN2
SCHEMBL22438969 0.74 ESR2 (0.42) MAPTESR2ADORA1NR1H2USP2
SCHEMBL23921730 0.74 ESR2 (0.38) MAPTESR2NR1H2C5AR1F12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2991989-B1 IMIDAZO-TRIAZINE DERIVATIVES AS PDE10 INHIBITORS PFIZER (US) 2017-06-28 EP disclosed
EP-2991989-B1 IMIDAZO-TRIAZINE DERIVATIVES AS PDE10 INHIBITORS PFIZER (US) 2017-06-28 EP disclosed
US-9296761-B2 Triazine derivatives PFIZER INC. (US) 2016-03-29 US disclosed
US-9296761-B2 Triazine derivatives PFIZER INC. (US) 2016-03-29 US disclosed
US-9296761-B2 Triazine derivatives PFIZER INC. (US) 2016-03-29 US disclosed
EP-2991989-A1 IMIDAZO-TRIAZINE DERIVATIVES AS PDE10 INHIBITORS Pfizer Inc. (US) 2016-03-09 EP disclosed
US-20150353579-A1 Triazine Derivatives PFIZER (US) 2015-12-10 US disclosed
US-20150353579-A1 Triazine Derivatives PFIZER (US) 2015-12-10 US disclosed
US-20150353579-A1 Triazine Derivatives PFIZER (US) 2015-12-10 US disclosed
US-9145427-B2 Triazine derivatives PFIZER INC. (US) 2015-09-29 US disclosed
US-20150080401-A1 Triazine Derivatives PFIZER (US) 2015-03-19 US disclosed
US-20150080401-A1 Triazine Derivatives PFIZER (US) 2015-03-19 US disclosed
US-8933224-B2 Triazine derivatives PFIZER INC. (US) 2015-01-13 US disclosed
US-8933224-B2 Triazine derivatives PFIZER INC. (US) 2015-01-13 US disclosed
US-8933224-B2 Triazine derivatives PFIZER INC. (US) 2015-01-13 US disclosed
US-20140329820-A1 Triazine Derivatives PFIZER INC. (US) 2014-11-06 US disclosed
US-20140329820-A1 Triazine Derivatives PFIZER INC. (US) 2014-11-06 US disclosed
WO-2014177977-A1 IMIDAZO-TRIAZINE DERIVATIVES AS PDE10 INHIBITORS PFIZER INC. (US) 2014-11-06 WO disclosed
WO-2014177977-A1 IMIDAZO-TRIAZINE DERIVATIVES AS PDE10 INHIBITORS PFIZER INC. (US) 2014-11-06 WO disclosed
US-20140329820-A1 Triazine Derivatives PFIZER INC. (US) 2014-11-06 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 (3 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-20140329820-A1 Triazine Derivatives PDE12, PDE5A, PDE10A MAPT 3633/4885ESR2 2152/4885ADORA1 588/4885
US-20150353579-A1 Triazine Derivatives PDE12, PDE5A, PDE10A MAPT 3633/4885ESR2 2152/4885ADORA1 588/4885
US-20150080401-A1 Triazine Derivatives PDE12, PDE5A, PDE10A MAPT 3633/4885ESR2 2152/4885ADORA1 588/4885

“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.