SCHEMBL9733209

SCHEMBL9733209

CNCc1cnc2ccccc2n1

nearest known ligand 0.62

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 8/20 0.62
MEN1 O00255 1/20 0.58
MAPT P10636 1/20 0.58
KMT2A Q03164 1/20 0.58
CYP1A2 P05177 1/20 0.44
CYP2C9 P11712 1/20 0.44
HIF1A Q16665 1/20 0.44
KDM4E B2RXH2 3/20 0.42
GAA P10253 2/20 0.42
ALDH1A1 P00352 1/20 0.42
POLB P06746 1/20 0.42
HSP90AA1 P07900 1/20 0.42
HSP90AB1 P08238 1/20 0.42
PKM P14618 1/20 0.42
PDGFRB P09619 1/20 0.42
PDGFRA P16234 1/20 0.42

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
SCHEMBL24449038 0.80 PDE10A (0.56) PDE10AMEN1MAPTKMT2ACYP1A2
SCHEMBL21674292 0.79 PDE10A (0.55) PDE10AMEN1MAPTKMT2ACYP1A2
SCHEMBL5792272 0.78 PDE10A (0.69) PDE10AMEN1MAPTKMT2ACYP1A2
SCHEMBL31694655 0.78 PDE10A (0.69) PDE10AMEN1MAPTKMT2ACYP1A2
SCHEMBL12066225 0.77 PDE10A (1.00) PDE10AMEN1MAPTKMT2A
SCHEMBL6006477 0.77 PDE10A (0.56) PDE10AMEN1MAPTKMT2ACYP1A2
SCHEMBL6006695 0.77 PDE10A (0.56) PDE10AMEN1MAPTKMT2ACYP1A2
SCHEMBL13271204 0.76 ACHE (0.47) PDE10AMEN1MAPTKMT2ACYP1A2
SCHEMBL16421411 0.74 PDE10A (0.64) PDE10AMEN1MAPTKMT2ACYP1A2
SCHEMBL2924050 0.74 NCF1 (0.53) PDE10ACYP1A2KDM4EPKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230203048-A1 SPIROPYRROLIDINE DERIVED ANTIVIRAL AGENTS ENANTA PHARMACEUTICALS, INC. 2023-06-29 US disclosed
US-5104892-A N-heteroalkyl substitutes 1-aryloxy-2-propanolamine AMERICAN HOME PRODUCTS CORPORATION (US) 1992-04-14 US disclosed
US-5084463-A Cardiovascular disorders AMERICAN HOME PRODUCTS CORPORATION (US) 1992-01-28 US disclosed
WO-1991009023-A1 N-HETEROARALKYL-SUBSTITUTED 1-ARYLOXY-2-PROPANOLAMINE AND PROPYLAMINE DERIVATIVES POSSESSING CLASS III ANTIARRHYTHMIC ACTIVITY AMERICAN HOME PRODUCTS CORPORATION (US) 1991-06-27 WO 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-20230203048-A1 SPIROPYRROLIDINE DERIVED ANTIVIRAL AGENTS ACE, ACE2, PKD1 PDE10A 1188/4885MEN1 3064/4885MAPT 3807/4885

“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.