SCHEMBL21209154

SCHEMBL21209154

CCOC(=O)C[C@H](C)N[C@@H](C)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.49
ALDH1A1 P00352 3/20 0.47
TSHR P16473 1/20 0.47
MMP8 P22894 1/20 0.47
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
ALOX5 P09917 1/20 0.44
F2 P00734 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C19 P33261 1/20 0.43
APAF1 O14727 1/20 0.43
MMP9 P14780 1/20 0.43
KDM4E B2RXH2 1/20 0.43
POLB P06746 1/20 0.43

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
SCHEMBL17695118 1.00 SIGMAR1 (0.49) SIGMAR1ALDH1A1TSHRMMP8MEN1
SCHEMBL4853881 0.87 ALDH1A1 (0.47) SIGMAR1ALDH1A1TSHRMMP8MEN1
SCHEMBL8119650 0.86 SIGMAR1 (0.53) SIGMAR1ALDH1A1MEN1KMT2AAPAF1
SCHEMBL20577929 0.86 SIGMAR1 (0.53) SIGMAR1ALDH1A1MEN1KMT2AAPAF1
SCHEMBL4851208 0.86 SIGMAR1 (0.53) SIGMAR1ALDH1A1MEN1KMT2AAPAF1
SCHEMBL2798487 0.85 CYP3A4 (0.47) SIGMAR1ALDH1A1MMP8MEN1KMT2A
SCHEMBL21193183 0.80 SIGMAR1 (0.58) SIGMAR1MEN1KMT2AAPAF1POLB
SCHEMBL4891321 0.80 SIGMAR1 (0.58) SIGMAR1MEN1KMT2AAPAF1POLB
SCHEMBL4884771 0.80 SIGMAR1 (0.58) SIGMAR1MEN1KMT2AAPAF1POLB
SCHEMBL4884782 0.80 SIGMAR1 (0.58) SIGMAR1MEN1KMT2AAPAF1POLB

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
EP-4616913-A2 GCN2 INHIBITORS AND USES THEREOF Merck Patent GmbH (DE) 2025-09-17 EP disclosed
EP-3746075-B1 GCN2 INHIBITORS AND USES THEREOF MERCK PATENT GMBH (DE) 2025-09-03 EP disclosed
US-20220340577-A1 GCN2 INHIBITORS AND USES THEREOF VERTEX PHARMACEUTICALS INCORPORATED 2022-10-27 US disclosed
US-20220340577-A1 GCN2 INHIBITORS AND USES THEREOF VERTEX PHARMACEUTICALS INCORPORATED 2022-10-27 US disclosed
US-10988477-B2 GCN2 inhibitors and uses thereof MERCK PATENT GMBH (DE) 2021-04-27 US disclosed
WO-2019148132-A1 GCN2 INHIBITORS AND USES THEREOF MERCK PATENT GMBH (DE) 2019-08-01 WO disclosed
US-20190233425-A1 GCN2 INHIBITORS AND USES THEREOF MERCK PATENT GMBH (DE) 2019-08-01 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 (3 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-20220340577-A1 GCN2 INHIBITORS AND USES THEREOF EIF2AK4, GCN1, GCGR SIGMAR1 2011/4885ALDH1A1 4414/4885TSHR 4808/4885
US-10988477-B2 GCN2 inhibitors and uses thereof EIF2AK4, GCN1, EIF2AK1 SIGMAR1 2335/4885ALDH1A1 4754/4885TSHR 4675/4885
US-20190233425-A1 GCN2 INHIBITORS AND USES THEREOF EIF2AK4, GCN1, GCGR SIGMAR1 2011/4885ALDH1A1 4414/4885TSHR 4808/4885

“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.