SCHEMBL24063504

SCHEMBL24063504

N#Cc1c(Nc2ccccc2)c2ncccc2[nH]c1=O

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PDE9A O76083 4/20 0.53
▸ PARP1 P09874 3/20 0.50
▸ KCNMA1 Q12791 7/20 0.48
▸ GRM4 Q14833 1/20 0.44
▸ MAPT P10636 1/20 0.43
▸ MAP2K1 Q02750 1/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ PYGM P11217 1/20 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
SCHEMBL24063492 0.89 PDE9A (0.65) PDE9APARP1KCNMA1KDM4E
SCHEMBL24276341 0.89 PDE9A (0.50) PDE9APARP1KCNMA1GRM4MAPT
SCHEMBL24063436 0.87 PDE9A (0.51) PDE9APARP1KCNMA1MAPTNPSR1
SCHEMBL24276323 0.82 PDE9A (0.51) PDE9APARP1KCNMA1KDM4E
SCHEMBL6682463 0.80 KCNMA1 (0.57) PDE9APARP1KCNMA1GRM4MAPT
SCHEMBL24275690 0.80 PDE9A (0.58) PDE9APARP1MAPTMAP2K1NPSR1
SCHEMBL20870616 0.76 KDM5A (0.59) PDE9APARP1MAPTMAP2K1NPSR1
SCHEMBL20870085 0.75 KCNMA1 (0.63) PDE9APARP1KCNMA1KDM4E
SCHEMBL4754780 0.75 PDE9A (0.60) PDE9APARP1KCNMA1KDM4E
SCHEMBL22275015 0.75 PDE9A (0.48) PDE9APARP1KCNMA1GRM4KDM4E

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-20220089593-A1 PDE9 INHIBITOR AND USE THEREOF TRANSTHERA SCIENCES (NANJING), INC. (CN) 2022-03-24 — — US disclosed
EP-3915992-A1 PDE9 INHIBITOR AND USE THEREOF Transthera Sciences (Nanjing), Inc. (CN) 2021-12-01 — — EP 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-20220089593-A1 PDE9 INHIBITOR AND USE THEREOF PDE9A, PDE12, PDE5A PDE9A 1/4885PARP1 2794/4885KCNMA1 1919/4885

“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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