SCHEMBL20183040

SCHEMBL20183040

CO[C@@H](C(=O)NN)c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.60
SMN1; SMN2 Q16637 1/20 0.60
ALDH1A1 P00352 6/20 0.59
GAA P10253 2/20 0.59
CTSD P07339 1/20 0.58
L3MBTL1 Q9Y468 4/20 0.58
LMNA P02545 2/20 0.55
PKM P14618 1/20 0.55
KDM4E B2RXH2 1/20 0.55
RECQL P46063 1/20 0.54
RAB9A P51151 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
KEAP1 Q14145 1/20 0.51
NFE2L2 Q16236 1/20 0.51
GLS O94925 1/20 0.49

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
SCHEMBL20183041 1.00 KMT2A (0.60) KMT2ASMN1; SMN2ALDH1A1GAACTSD
SCHEMBL11870023 1.00 KMT2A (0.60) KMT2ASMN1; SMN2ALDH1A1GAACTSD
SCHEMBL13434151 0.83 ALDH1A1 (0.64) KMT2ASMN1; SMN2ALDH1A1GAAL3MBTL1
SCHEMBL8281830 0.83 ALDH1A1 (0.64) KMT2ASMN1; SMN2ALDH1A1GAAL3MBTL1
SCHEMBL28091502 0.81 CTSD (0.58) KMT2ASMN1; SMN2ALDH1A1GAACTSD
SCHEMBL8049390 0.81 ALDH1A1 (0.77) KMT2ASMN1; SMN2ALDH1A1GAAL3MBTL1
Hydrochloric Acid SCHEMBL1533369 0.81 CA1 (0.50) KMT2ASMN1; SMN2ALDH1A1GAARAB9A
SCHEMBL1578720 0.80 UTS2R (0.53) KMT2ASMN1; SMN2
SCHEMBL1579147 0.80 ALDH1A1 (0.47) KMT2ASMN1; SMN2ALDH1A1GAAL3MBTL1
SCHEMBL12282275 0.79 PKM (0.64) KMT2ASMN1; SMN2ALDH1A1GAAL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3541802-B1 ALKYL SUBSTITUTED TRIAZOLE COMPOUNDS AS AGONISTS OF THE APJ RECEPTOR AMGEN INC (US) 2025-01-01 EP disclosed
US-11191762-B2 Alkyl substituted triazole compounds as agonists of the APJ Receptor AMGEN INC. (US) 2021-12-07 US disclosed
US-20190290647-A1 ALKYL SUBSTITUTED TRIAZOLE COMPOUNDS AS AGONISTS OF THE APJ RECEPTOR AMGEN INC. (US) 2019-09-26 US disclosed
WO-2018093576-A1 ALKYL SUBSTITUTED TRIAZOLE COMPOUNDS AS AGONISTS OF THE APJ RECEPTOR AMGEN INC. (US) 2018-05-24 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 (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-11191762-B2 Alkyl substituted triazole compounds as agonists of the APJ Receptor AGTR1, AGTR2, APLNR KMT2A 3639/4885SMN1; SMN2 4701/4885ALDH1A1 2364/4885
US-20190290647-A1 ALKYL SUBSTITUTED TRIAZOLE COMPOUNDS AS AGONISTS OF THE APJ RECEPTOR AGTR1, AGTR2, APLNR KMT2A 3639/4885SMN1; SMN2 4701/4885ALDH1A1 2364/4885

“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.