SCHEMBL6687216

SCHEMBL6687216

N#Cc1c(NCc2ccccc2)[nH]c2cccnc12

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KCNMA1 Q12791 10/20 0.54
▸ HPGD P15428 2/20 0.48
▸ KDM4E B2RXH2 2/20 0.48
▸ ALDH1A1 P00352 1/20 0.48
▸ SMN1; SMN2 Q16637 2/20 0.45
▸ LMNA P02545 1/20 0.45
▸ TSHR P16473 1/20 0.45
▸ HTT P42858 1/20 0.45
▸ MAPK10 P53779 1/20 0.45
▸ EGFR P00533 1/20 0.44
▸ TP53 P04637 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ PDE9A O76083 1/20 0.43
▸ FABP1 P07148 1/20 0.42
▸ FABP6 P51161 1/20 0.42
▸ RPS6KB1 P23443 1/20 0.41
▸ BACE1 P56817 1/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ L3MBTL1 Q9Y468 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
SCHEMBL24276323 0.82 PDE9A (0.51) KCNMA1HPGDKDM4EALDH1A1SMN1; SMN2
SCHEMBL6682463 0.79 KCNMA1 (0.57) KCNMA1TSHRHTTPDE9A
SCHEMBL19378110 0.77 KCNMA1 (0.52) KCNMA1PDE9A
SCHEMBL31261456 0.75 KCNMA1 (0.68) KCNMA1PDE9A
SCHEMBL19377850 0.74 KCNMA1 (0.43) KCNMA1PDE9A
SCHEMBL22275015 0.72 PDE9A (0.48) KCNMA1HPGDKDM4EALDH1A1LMNA
SCHEMBL28284325 0.71 TP53 (0.63) SMN1; SMN2LMNAHTTTP53RAB9A
SCHEMBL7291924 0.70 PDE4A (0.52) HPGDKDM4EALDH1A1SMN1; SMN2LMNA
SCHEMBL30052094 0.70 KCNMA1 (0.66) KCNMA1PDE9A
SCHEMBL23885624 0.70 KCNMA1 (0.66) KCNMA1PDE9A

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 12/4885HPGD 1621/4885KDM4E 872/4885
US-20040192697-A1 Pyrrolopyridine potassium channel openers KCNJ2, KCNN1, KCNN2 KCNMA1 12/4885HPGD 1621/4885KDM4E 872/4885

“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.

Send feedback