SCHEMBL16701251

SCHEMBL16701251

NC(=O)c1ccnn1C1CCn2nc(-c3ccccc3)nc2C1

nearest known ligand 0.41

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ PDE10A Q9Y233 19/20 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
SCHEMBL16699926 0.80 WDR5 (0.43) PDE10A
SCHEMBL16003887 0.73 PDE10A (0.45) PDE10A
SCHEMBL16003898 0.71 CKS1B (0.40) PDE10A
SCHEMBL4043341 0.70 KMT2A (0.43) —
Hydrochloric Acid SCHEMBL16341064 0.70 CKS1B (0.40) PDE10A
SCHEMBL16700931 0.68 PDE10A (0.41) PDE10A
SCHEMBL26396444 0.68 NR3C2 (0.46) —
SCHEMBL26416283 0.68 NR3C2 (0.49) —
SCHEMBL16320708 0.66 PDE10A (0.43) PDE10A
SCHEMBL14335158 0.66 KMT2A (0.54) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9440970-B2 Pyrazole derivative MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2016-09-13 — — US disclosed
US-20150133448-A1 NOVEL PYRAZOLE DERIVATIVE MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2015-05-14 — — 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 (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-20150133448-A1 NOVEL PYRAZOLE DERIVATIVE PDE10A, PDE3A, PDE5A PDE10A 1/4885

“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.

Send feedback