SCHEMBL6682463

SCHEMBL6682463

N#Cc1c(Nc2ccccc2)[nH]c2cccnc12

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ KCNMA1 Q12791 12/20 0.57
▸ GRM4 Q14833 1/20 0.49
▸ MEN1 O00255 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ PDE9A O76083 1/20 0.43
▸ HTT P42858 1/20 0.43
▸ PARP1 P09874 1/20 0.42
▸ TSHR P16473 1/20 0.42
▸ MAPT P10636 1/20 0.41
▸ MAP2K1 Q02750 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
SCHEMBL24063504 0.80 PDE9A (0.53) KCNMA1GRM4PDE9APARP1MAPT
SCHEMBL6687216 0.79 KCNMA1 (0.54) KCNMA1PDE9AHTTTSHR
SCHEMBL31261456 0.74 KCNMA1 (0.68) KCNMA1PDE9APARP1
SCHEMBL6702066 0.73 KCNMA1 (1.00) KCNMA1PDE9APARP1MAPT
SCHEMBL6686574 0.73 KCNMA1 (0.66) KCNMA1GRM4PDE9APARP1MAPT
SCHEMBL23885624 0.73 KCNMA1 (0.66) KCNMA1PDE9APARP1MAP2K1
SCHEMBL30052094 0.73 KCNMA1 (0.66) KCNMA1PDE9APARP1MAP2K1
SCHEMBL19378110 0.72 KCNMA1 (0.52) KCNMA1PDE9A
SCHEMBL6686120 0.71 KCNMA1 (1.00) KCNMA1MEN1KMT2APDE9APARP1
SCHEMBL24276341 0.69 PDE9A (0.50) KCNMA1GRM4PDE9APARP1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040192697-A1 Pyrrolopyridine potassium channel openers ABBOTT LABORATORIES 2004-09-30 — — US claimed
WO-2004060893-A1 PYRROLOPYRIDINE POTASSIUM CHANNEL OPENERS ABBOTT LABORATORIES (US) 2004-07-22 — — WO claimed
US-20040122218-A1 Pyrrolopyridine potassium channel openers ABBOTT LABORATORIES 2004-06-24 — — US claimed
US-20040192697-A1 Pyrrolopyridine potassium channel openers ABBOTT LABORATORIES 2004-09-30 — — US disclosed
WO-2004060893-A1 PYRROLOPYRIDINE POTASSIUM CHANNEL OPENERS ABBOTT LABORATORIES (US) 2004-07-22 — — WO disclosed
US-20040122218-A1 Pyrrolopyridine potassium channel openers ABBOTT LABORATORIES 2004-06-24 — — 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 (2 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-20040122218-A1 Pyrrolopyridine potassium channel openers KCNJ2, KCNN1, KCNN2 KCNMA1 12/4885GRM4 1468/4885MEN1 2416/4885
US-20040192697-A1 Pyrrolopyridine potassium channel openers KCNJ2, KCNN1, KCNN2 KCNMA1 12/4885GRM4 1468/4885MEN1 2416/4885

“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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