SCHEMBL17658629

SCHEMBL17658629

O=C(COc1ccc(I)cc1)N[C@H]1CC[C@H](NC(=O)COc2ccc(I)cc2)CC1

nearest known ligand 0.72

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 4/20 0.72
▸ ATF4 P18848 3/20 0.72
▸ HTT P42858 2/20 0.62
▸ HPGD P15428 1/20 0.62
▸ RAB9A P51151 1/20 0.62
▸ SMN1; SMN2 Q16637 3/20 0.60
▸ KMT2A Q03164 3/20 0.60
▸ ALDH1A1 P00352 2/20 0.60
▸ MEN1 O00255 2/20 0.60
▸ MAPK1 P28482 1/20 0.59
▸ L3MBTL1 Q9Y468 1/20 0.58

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
SCHEMBL19538649 0.94 KMT2A (0.68) LMNAATF4HTTSMN1; SMN2KMT2A
SCHEMBL16082960 0.93 ATF4 (0.86) LMNAATF4HTTHPGDRAB9A
SCHEMBL19134248 0.93 LMNA (0.63) LMNAATF4HTTHPGDRAB9A
SCHEMBL19659333 0.92 KMT2A (0.69) LMNAATF4HTTSMN1; SMN2KMT2A
SCHEMBL17946625 0.88 LMNA (0.59) LMNAATF4HTTHPGDRAB9A
SCHEMBL16082980 0.84 ATF4 (1.00) LMNAATF4HTTHPGDRAB9A
SCHEMBL17658518 0.84 LMNA (0.72) LMNAATF4HTTHPGDRAB9A
SCHEMBL17658509 0.84 LMNA (0.72) LMNAATF4HTTHPGDRAB9A
SCHEMBL12629118 0.84 LMNA (0.72) LMNAATF4HTTHPGDRAB9A
SCHEMBL16083047 0.84 ATF4 (1.00) LMNAATF4HTTHPGDRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11220477-B2 Modulators of the eIF2alpha pathway THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2022-01-11 — — US disclosed
US-10343981-B2 Modulators of the eIF2alpha pathway THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2019-07-09 — — US disclosed
US-20170342020-A1 MODULATORS OF THE EIF2ALPHA PATHWAY THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2017-11-30 — — US disclosed
US-9708247-B2 Modulators of the eIF2alpha pathway THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2017-07-18 — — US disclosed
US-20160096800-A1 MODULATORS OF THE EIF2ALPHA PATHWAY THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2016-04-07 — — 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 (4 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-20170342020-A1 MODULATORS OF THE EIF2ALPHA PATHWAY EIF2AK1, EIF2A, EIF2AK3 LMNA 3251/4885ATF4 7/4885HTT 1451/4885
US-11220477-B2 Modulators of the eIF2alpha pathway EIF2AK1, EIF2A, EIF2AK3 LMNA 3251/4885ATF4 7/4885HTT 1451/4885
US-20160096800-A1 MODULATORS OF THE EIF2ALPHA PATHWAY EIF2AK1, EIF2A, EIF2AK3 LMNA 3251/4885ATF4 7/4885HTT 1451/4885
US-10343981-B2 Modulators of the eIF2alpha pathway EIF2AK1, EIF2A, EIF2AK3 LMNA 3251/4885ATF4 7/4885HTT 1451/4885

“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.

Send feedback