SCHEMBL21210697

SCHEMBL21210697

CCCCCS(=O)(=O)N1CCOCC1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.49
ALDH1A1 P00352 3/20 0.49
CA12 O43570 1/20 0.45
CA7 P43166 1/20 0.45
CA14 Q9ULX7 1/20 0.45
KDM4E B2RXH2 1/20 0.43
SMN1; SMN2 Q16637 3/20 0.42
CYP1A2 P05177 1/20 0.41
TSHR P16473 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
THRB P10828 2/20 0.39
FAAH O00519 1/20 0.38
POLB P06746 1/20 0.38
HTT P42858 1/20 0.38

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
SCHEMBL7856439 0.98 ALDH1A1 (0.48) LMNAALDH1A1CA12CA7CA14
SCHEMBL16372265 0.98 ALDH1A1 (0.48) LMNAALDH1A1CA12CA7CA14
SCHEMBL20372908 0.98 ALDH1A1 (0.48) LMNAALDH1A1CA12CA7CA14
SCHEMBL7297373 0.94 ALDH1A1 (0.50) LMNAALDH1A1CA12CA7CA14
SCHEMBL4547019 0.86 ALDH1A1 (0.61) LMNAALDH1A1CA12CA7CA14
SCHEMBL17832935 0.84 THRB (0.46) LMNAALDH1A1CYP1A2THRB
SCHEMBL10722736 0.84 FAAH (0.48) ALDH1A1KDM4EL3MBTL1THRBFAAH
SCHEMBL10721831 0.84 FAAH (0.48) ALDH1A1KDM4EL3MBTL1THRBFAAH
SCHEMBL7122564 0.84 FAAH (0.48) ALDH1A1KDM4EL3MBTL1THRBFAAH
SCHEMBL22600626 0.82 LMNA (0.42) LMNAALDH1A1CA12CA7CA14

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-10988477-B2 GCN2 inhibitors and uses thereof MERCK PATENT GMBH (DE) 2021-04-27 US 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 (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-10988477-B2 GCN2 inhibitors and uses thereof EIF2AK4, GCN1, EIF2AK1 LMNA 3908/4885ALDH1A1 4754/4885CA12 4498/4885
US-20190233425-A1 GCN2 INHIBITORS AND USES THEREOF EIF2AK4, GCN1, GCGR LMNA 3246/4885ALDH1A1 4414/4885CA12 3913/4885

“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.