SCHEMBL16320986

SCHEMBL16320986

CC(C)(C)N(C(=O)O)C1CCn2nc(-c3ccc(F)cc3)nc2C1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PDE10A Q9Y233 14/20 0.42
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ GRM5 P41594 2/20 0.36
▸ PDK2 Q15119 1/20 0.34
▸ HDAC4 P56524 1/20 0.34
▸ GPR119 Q8TDV5 1/20 0.34

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
SCHEMBL16320708 0.90 PDE10A (0.43) PDE10A
SCHEMBL16340802 0.78 — —
SCHEMBL16003886 0.77 NOTUM (0.45) PDE10AMEN1KMT2AGRM5
SCHEMBL16320445 0.74 PDE10A (0.58) PDE10A
SCHEMBL16340755 0.72 GPR119 (0.35) MEN1KMT2APDK2GPR119
SCHEMBL16340966 0.72 PDE10A (0.43) PDE10AGRM5
SCHEMBL16003900 0.71 NPC1 (0.42) PDE10AGRM5
SCHEMBL28879588 0.70 PDE10A (0.42) PDE10AMEN1KMT2AGRM5
SCHEMBL16320993 0.70 PDE10A (0.47) PDE10A
Hydrochloric Acid SCHEMBL16341551 0.70 NPC1 (0.41) PDE10AGRM5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140378447-A1 NOVEL PYRAZOLE DERIVATIVE MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2014-12-25 — — 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-20140378447-A1 NOVEL PYRAZOLE DERIVATIVE PDE10A, PDE3A, PDE5A PDE10A 1/4885MEN1 4110/4885KMT2A 2932/4885

“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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