SCHEMBL21217551

SCHEMBL21217551

OC(c1ccccc1)(c1ccccc1)c1cc2ccccc2nc1-c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE10A Q9Y233 2/20 0.51
▸ KMT2A Q03164 2/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ AKT1 P31749 2/20 0.41
▸ AKT2 P31751 1/20 0.41
▸ KDM4E B2RXH2 5/20 0.40
▸ PKM P14618 1/20 0.40
▸ ALDH1A1 P00352 4/20 0.39
▸ HPGD P15428 3/20 0.39
▸ GLA P06280 2/20 0.39
▸ MAPT P10636 1/20 0.39
▸ ACHE P22303 1/20 0.39
▸ L3MBTL1 Q9Y468 3/20 0.39
▸ GAA P10253 2/20 0.39
▸ LMNA P02545 2/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ CYP1A2 P05177 1/20 0.38
▸ CYP2D6 P10635 1/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38

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
SCHEMBL21217954 0.87 CYP2D6 (0.44) PDE10AKMT2AMEN1AKT1AKT2
SCHEMBL1326238 0.72 PDE10A (0.61) PDE10AKMT2AMEN1AKT1KDM4E
SCHEMBL3359420 0.70 PSMB5 (0.65) PDE10AKMT2AMEN1AKT1KDM4E
SCHEMBL29374375 0.70 PSMB5 (0.65) PDE10AKMT2AMEN1AKT1KDM4E
SCHEMBL6644253 0.68 PDE10A (0.61) PDE10AKMT2AMEN1AKT1AKT2
SCHEMBL2125225 0.68 PDE10A (1.00) PDE10AKMT2AMEN1KDM4EPKM
SCHEMBL10506211 0.68 PDE10A (0.61) PDE10AKMT2AMEN1AKT1AKT2
SCHEMBL10509422 0.68 PDE10A (0.61) PDE10AKMT2AMEN1AKT1KDM4E
SCHEMBL31517155 0.68 PDE10A (0.61) PDE10AKMT2AMEN1AKT1AKT2
SCHEMBL31054483 0.68 PSMB5 (0.63) PDE10AKMT2AMEN1AKT1KDM4E

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-20190237678-A1 ORGANIC PHOTOELECTRIC FUNCTIONAL MATERIAL, METHOD FOR PREPARING THE SAME, USE OF THE SAME, ORGANIC ELECTRONIC ASSEMBLY, AND LIGHT-EMITTING DEVICE Nanjing Tech Universiy (CN) 2019-08-01 — — 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-20190237678-A1 ORGANIC PHOTOELECTRIC FUNCTIONAL MATERIAL, METHOD FOR PREPARING THE SAME, USE OF THE SAME, ORGANIC ELECTRONIC ASSEMBLY, AND LIGHT-EMITTING DEVICE FARS2, PPOX, ETFA PDE10A 3276/4885KMT2A 1880/4885MEN1 3646/4885

“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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