SCHEMBL26233333

SCHEMBL26233333

CC(=O)c1ccc(Cn2nc3c(c2Nc2ccccc2)c(=O)n(C)c(=O)n3CC(C)C)cc1

nearest known ligand 0.69

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PDE1B Q01064 8/20 0.69
PDE1A P54750 7/20 0.69
PDE1C Q14123 6/20 0.69
PDE2A O00408 5/20 0.47
PDE4D Q08499 1/20 0.47
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
PDE4A P27815 2/20 0.37
P2RX3 P56373 1/20 0.37

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
SCHEMBL17507919 0.94 PDE1B (0.70) PDE1BPDE1APDE1CPDE2APDE4D
SCHEMBL194194 0.92 PDE1B (0.68) PDE1BPDE1APDE1CPDE2APDE4D
SCHEMBL194641 0.89 PDE1B (0.73) PDE1BPDE1APDE1CPDE2APDE4D
SCHEMBL3091517 0.88 PDE1B (0.72) PDE1BPDE1APDE1CPDE2APDE4D
SCHEMBL3666558 0.88 PDE1B (0.72) PDE1BPDE1APDE1CPDE2APDE4D
SCHEMBL17539953 0.87 PDE1B (0.68) PDE1BPDE1APDE1CPDE2APDE4D
SCHEMBL3087225 0.86 PDE1B (0.69) PDE1BPDE1APDE1CPDE2APDE4D
SCHEMBL3094574 0.86 PDE1B (0.76) PDE1BPDE1APDE1CPDE2APDE4D
SCHEMBL194205 0.86 PDE1B (0.69) PDE1BPDE1APDE1CPDE2APDE4D
SCHEMBL17507915 0.85 PDE1B (0.68) PDE1BPDE1APDE1CPDE2APDE4D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230355625-A1 METHODS OF TREATMENT INTRA-CELLULAR THERAPIES, INC. 2023-11-09 US disclosed
US-20230338385-A1 NOVEL USES INTRA-CELLULAR THERAPIES, INC. 2023-10-26 US disclosed
US-11759465-B2 Uses INTRA-CELLULAR THERAPIES, INC. (US) 2023-09-19 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 (3 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-20230355625-A1 METHODS OF TREATMENT PDE1A, PDE1B, PDE7A PDE1B 2/4885PDE1A 1/4885PDE1C 5/4885
US-20230338385-A1 NOVEL USES ADORA2A, ATP2A1, ADORA2B PDE1B 13/4885PDE1A 8/4885PDE1C 28/4885
US-11759465-B2 Uses ADORA2A, ADORA2B, ADORA1 PDE1B 16/4885PDE1A 9/4885PDE1C 30/4885

“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.