SCHEMBL20189871

SCHEMBL20189871

CCc1csc(C(=S)Nc2c(OC)cccc2OC)n1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.39
ALDH1A1 P00352 10/20 0.38
LMNA P02545 4/20 0.38
MAPT P10636 4/20 0.38
MEN1 O00255 3/20 0.38
ALOX12 P18054 3/20 0.38
KMT2A Q03164 3/20 0.38
KDM4E B2RXH2 6/20 0.38
MAPK1 P28482 1/20 0.38
HPGD P15428 2/20 0.37
HSD17B10 Q99714 2/20 0.37
HTT P42858 2/20 0.37
SMN1; SMN2 Q16637 5/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
SHMT2 P34897 2/20 0.35

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
SCHEMBL20189779 0.85 KDM4E (0.45) GAAALDH1A1LMNAKDM4EMAPK1
SCHEMBL20207360 0.85 GAA (0.39) GAAALDH1A1LMNAMAPTMEN1
SCHEMBL20188875 0.81 GAA (0.37) GAAALDH1A1LMNAKDM4EMAPK1
SCHEMBL22537280 0.81 GAA (0.37) GAAALDH1A1LMNAKDM4EMAPK1
SCHEMBL20188874 0.81 GAA (0.37) GAAALDH1A1LMNAKDM4EMAPK1
SCHEMBL20190237 0.73 GAA (0.43) GAAALDH1A1LMNAMAPTMEN1
SCHEMBL28490597 0.72 ALDH1A1 (0.36) GAAALDH1A1LMNAMAPTMEN1
SCHEMBL2378961 0.68 GAA (0.46) GAAALDH1A1LMNAMAPTMEN1
SCHEMBL20189397 0.68 KMT2A (0.49) ALDH1A1LMNAMAPTKMT2AKDM4E
SCHEMBL23026124 0.68 MAPK8 (0.44) GAAALDH1A1MAPTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11046680-B1 Heteroaryl-substituted triazoles as APJ receptor agonists AMGEN INC. (US) 2021-06-29 US disclosed
US-11046680-B1 Heteroaryl-substituted triazoles as APJ receptor agonists AMGEN INC. (US) 2021-06-29 US disclosed
EP-3541805-B1 HETEROARYL-SUBSTITUTED TRIAZOLES AS APJ RECEPTOR AGONISTS AMGEN INC (US) 2020-10-14 EP disclosed
EP-3541805-B1 HETEROARYL-SUBSTITUTED TRIAZOLES AS APJ RECEPTOR AGONISTS AMGEN INC (US) 2020-10-14 EP disclosed
EP-3541805-A1 HETEROARYL-SUBSTITUTED TRIAZOLES AS APJ RECEPTOR AGONISTS Amgen Inc. (US) 2019-09-25 EP disclosed
WO-2018097945-A1 HETEROARYL-SUBSTITUTED TRIAZOLES AS APJ RECEPTOR AGONISTS AMGEN INC. (US) 2018-05-31 WO disclosed
WO-2018097945-A1 HETEROARYL-SUBSTITUTED TRIAZOLES AS APJ RECEPTOR AGONISTS AMGEN INC. (US) 2018-05-31 WO 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-11046680-B1 Heteroaryl-substituted triazoles as APJ receptor agonists AGTR1, AGTR2, TBXA2R GAA 4208/4885ALDH1A1 1929/4885LMNA 3334/4885

“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.