SCHEMBL19939404

SCHEMBL19939404

Cc1cn2nc(C)c(C)c2c(C)n1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.37
HPGD P15428 3/20 0.37
HSD17B10 Q99714 3/20 0.37
DYRK1A Q13627 1/20 0.33
KDM4E B2RXH2 2/20 0.30
TP53 P04637 2/20 0.30
MAPT P10636 2/20 0.30
CASP1 P29466 2/20 0.30
CASP7 P55210 2/20 0.30
SMN1; SMN2 Q16637 2/20 0.30
NPC1 O15118 1/20 0.30
MITF O75030 1/20 0.30
GAA P10253 1/20 0.30
RAB9A P51151 1/20 0.30
PKM P14618 1/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL19942294 0.82 ALDH1A1 (0.31) ALDH1A1HPGDHSD17B10DYRK1A
SCHEMBL24163736 0.79 COMT (0.35) ALDH1A1HPGDHSD17B10DYRK1A
SCHEMBL24163733 0.76 NPC1 (0.31) ALDH1A1HPGDHSD17B10KDM4ETP53
SCHEMBL14341761 0.74 ALDH1A1 (0.49) ALDH1A1HPGDHSD17B10DYRK1AKDM4E
SCHEMBL15069240 0.74 ALDH1A1 (0.31) ALDH1A1HPGDHSD17B10DYRK1AMAPT
SCHEMBL21894547 0.70 PIK3CG (0.33)
SCHEMBL24163187 0.69
SCHEMBL21266713 0.67 ALDH1A1 (0.32) ALDH1A1HPGDHSD17B10DYRK1A
SCHEMBL19942190 0.67 ALDH1A1 (0.39) ALDH1A1HPGDHSD17B10DYRK1A
SCHEMBL25818110 0.65 ALDH1A1 (0.41) ALDH1A1HPGDHSD17B10DYRK1AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180065971-A1 sGC STIMULATORS TISENTO THERAPEUTICS INC. 2018-03-08 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 (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-20180065971-A1 sGC STIMULATORS GUCY1A2, PRKG1, GMPS ALDH1A1 2650/4885HPGD 108/4885HSD17B10 2700/4885

“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.