SCHEMBL15033465

SCHEMBL15033465

Cc1cnc(C)n2nc(C[PH](c3ccccc3)(c3ccccc3)c3ccccc3)nc12

nearest known ligand 0.52

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 20/20 0.52

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
SCHEMBL19559357 0.84 PDE10A (0.42) PDE10A
SCHEMBL4543214 0.82 PDE10A (0.50) PDE10A
SCHEMBL259195 0.80 PDE10A (0.53) PDE10A
SCHEMBL15888097 0.79 PDE10A (0.42) PDE10A
SCHEMBL14124018 0.76 PDE10A (0.53) PDE10A
Hydrochloric Acid SCHEMBL7509327 0.75 PDE10A (0.51) PDE10A
SCHEMBL16541466 0.74 PDE10A (0.50) PDE10A
SCHEMBL10309400 0.73 PDE10A (0.49) PDE10A
SCHEMBL14124012 0.73 PDE10A (0.56) PDE10A
SCHEMBL14124016 0.72 PDE10A (0.50) PDE10A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180037590-A1 SUBSTITUTED QUINOLINES AS PDE-10 INHIBITORS SUNOVION PHARMACEUTICALS INC. 2018-02-08 US disclosed
US-9834564-B2 Substituted quinolines as PDE-10 inhibitors SUNOVION PHARMACEUTICALS INC. (US) 2017-12-05 US disclosed
EP-3074387-B1 IMIDAZOLE DERIVATIVES HOFFMANN LA ROCHE (CH) 2017-11-08 EP disclosed
US-9586970-B2 Imidazole derivatives HOFFMANN-LA ROCHE INC. (US) 2017-03-07 US disclosed
US-9586970-B2 Imidazole derivatives HOFFMANN-LA ROCHE INC. (US) 2017-03-07 US disclosed
EP-3074387-A1 IMIDAZOLE DERIVATIVES F.HOFFMANN-LA ROCHE AG (CH) 2016-10-05 EP disclosed
US-20160264585-A1 IMIDAZOLE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2016-09-15 US disclosed
US-20150166571-A1 Heteroaryl Compounds and Methods of Use Thereof SUNOVION PHARMACEUTICALS INC. 2015-06-18 US disclosed
WO-2015078836-A1 IMIDAZOLE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2015-06-04 WO disclosed
WO-2015078836-A1 IMIDAZOLE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2015-06-04 WO disclosed
US-8969349-B2 Substituted quinoxalines and quinoxalinones as PDE-10 inhibitors SUNOVION PHARMACEUTICALS INC. (US) 2015-03-03 US disclosed
US-20130158003-A1 HETEROARYL COMPOUNDS AND METHODS OF USE THEREOF SUNOVION PHARMACEUTICALS INC (US) 2013-06-20 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 (4 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-20180037590-A1 SUBSTITUTED QUINOLINES AS PDE-10 INHIBITORS PDE10A, PDE2A, PDE3A PDE10A 1/4885
US-20160264585-A1 IMIDAZOLE DERIVATIVES GRIN2B, MAOB, GRIN2A PDE10A 1659/4885
US-20130158003-A1 HETEROARYL COMPOUNDS AND METHODS OF USE THEREOF COMT, GPR119, NLN PDE10A 2086/4885
US-20150166571-A1 Heteroaryl Compounds and Methods of Use Thereof COMT, GPR119, NLN PDE10A 2086/4885

“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.