SCHEMBL21067115

SCHEMBL21067115

Cc1nnc2c(C=O)cncn12

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.33
ALDH1A1 P00352 2/20 0.33
MAPT P10636 2/20 0.33
RAB9A P51151 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL24121996 0.75 NPC1 (0.39) NPC1ALDH1A1MAPTRAB9ASMN1; SMN2
SCHEMBL21067213 0.71 ALDH1A1 (0.39) NPC1ALDH1A1MAPTRAB9AHSD17B10
SCHEMBL21067265 0.67 KDM4E (0.31) HSD17B10
SCHEMBL31174800 0.64 CYP11B2 (0.34) ALDH1A1
SCHEMBL4561137 0.62 GRM2 (0.31)
SCHEMBL8352933 0.58 IDO1 (0.38)
SCHEMBL6629927 0.58 ALDH1A1 (0.39) NPC1ALDH1A1MAPTRAB9ASMN1; SMN2
SCHEMBL13313508 0.58 KDM4E (0.31) NPC1RAB9A
SCHEMBL20743849 0.57 IDO1 (0.43)
SCHEMBL20612512 0.57 TBXAS1 (0.34)

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-10766893-B2 1H-pyrazolo[4,3-b]pyridines as PDE1 inhibitors H. LUNDBECK A/S (DK) 2020-09-08 US disclosed
US-20190194189-A1 1H-PYRAZOLO[4,3-B]PYRIDINES AS PDE1 INHIBITORS H. LUNDBECK A/S (DK) 2019-06-27 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-10766893-B2 1H-pyrazolo[4,3-b]pyridines as PDE1 inhibitors PDE12, PDE3B, PDE5A NPC1 2349/4885ALDH1A1 90/4885MAPT 300/4885
US-20190194189-A1 1H-PYRAZOLO[4,3-B]PYRIDINES AS PDE1 INHIBITORS PDE12, PDE3B, PDE5A NPC1 2349/4885ALDH1A1 90/4885MAPT 300/4885

“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.