SCHEMBL21570100

SCHEMBL21570100

CN(CC(=O)O)C(=O)CN(C(=O)OC(C)(C)C)C(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MVD P53602 1/20 0.36
HDAC6 Q9UBN7 2/20 0.34
HDAC1 Q13547 1/20 0.34
HDAC2 Q92769 1/20 0.34
CTSL P07711 1/20 0.33
CTSB P07858 1/20 0.33
CTSS P25774 1/20 0.33

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
SCHEMBL52467 0.86 HDAC6 (0.40) HDAC6HDAC1HDAC2CTSLCTSB
SCHEMBL25133621 0.84 MVD (0.39) MVDHDAC6HDAC1HDAC2CTSL
SCHEMBL21069315 0.84 MVD (0.39) MVDHDAC6HDAC1HDAC2CTSL
SCHEMBL25134161 0.84 MVD (0.39) MVDHDAC6HDAC1HDAC2CTSL
SCHEMBL397071 0.84 MVD (0.39) MVDHDAC6HDAC1HDAC2CTSL
SCHEMBL22572467 0.84 KDM4E (0.35) HDAC6HDAC1HDAC2CTSLCTSB
SCHEMBL336495 0.80 HDAC6 (0.37) MVDHDAC6HDAC1HDAC2CTSL
Ammonia Solution, Strong SCHEMBL29062672 0.78 HDAC6 (0.36) MVDHDAC6HDAC1HDAC2CTSL
SCHEMBL20188230 0.74 ALDH1A1 (0.43)
SCHEMBL22690216 0.73 MVD (0.36) MVDHDAC6HDAC1HDAC2CTSL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4029868-B1 MCL-1 INHIBITORS GILEAD SCIENCES INC (US) 2026-05-20 EP disclosed
CN-117304130-A MCL-1 inhibitors 吉利德科学公司 2023-12-29 CN disclosed
US-20230312490-A1 MCL-1 INHIBITORS GILEAD SCIENCES, INC. 2023-10-05 US disclosed
US-20230312490-A1 MCL-1 INHIBITORS GILEAD SCIENCES, INC. 2023-10-05 US disclosed
US-20230312490-A1 MCL-1 INHIBITORS GILEAD SCIENCES, INC. 2023-10-05 US disclosed
CN-112118845-B MCL-1 inhibitors 吉利德科学公司 2023-06-13 CN disclosed
US-11643400-B2 MCL-1 inhibitors GILEAD SCIENCES, INC. (US) 2023-05-09 US disclosed
US-11643400-B2 MCL-1 inhibitors GILEAD SCIENCES, INC. (US) 2023-05-09 US disclosed
US-11643400-B2 MCL-1 inhibitors GILEAD SCIENCES, INC. (US) 2023-05-09 US disclosed
US-20220340535-A1 MCL-1 INHIBITORS GILEAD SCIENCES, INC. 2022-10-27 US disclosed
EP-4029868-A1 MCL-1 INHIBITORS GILEAD SCIENCES, INC. (US) 2022-07-20 EP disclosed
EP-3793565-B1 MCL-1 INHIBITORS GILEAD SCIENCES INC (US) 2022-01-05 EP disclosed
US-10988451-B2 MCL-1 inhibitors GILEAD SCIENCES, INC. (US) 2021-04-27 US disclosed
EP-3793565-A1 MCL-1 INHIBITORS Gilead Sciences, Inc. (US) 2021-03-24 EP disclosed
CN-112118845-A MCL-1 inhibitors 吉利德科学公司 2020-12-22 CN disclosed
US-20200331870-A1 MCL-1 INHIBITORS GILEAD SCIENCES, INC. 2020-10-22 US disclosed
US-10703733-B2 MCL-1 inhibitors GILEAD SCIENCES, INC. (US) 2020-07-07 US disclosed
US-10703733-B2 MCL-1 inhibitors GILEAD SCIENCES, INC. (US) 2020-07-07 US disclosed
US-20190352271-A1 MCL-1 INHIBITORS GILEAD SCIENCES, INC. 2019-11-21 US disclosed
US-20190352271-A1 MCL-1 INHIBITORS GILEAD SCIENCES, INC. 2019-11-21 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 (7 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-20190352271-A1 MCL-1 INHIBITORS MCL1, BCL2L1, BCL2 MVD 3068/4885HDAC6 178/4885HDAC1 204/4885
US-20200331870-A1 MCL-1 INHIBITORS MCL1, BCL2L1, BCL2 MVD 3068/4885HDAC6 178/4885HDAC1 204/4885
US-20230312490-A1 MCL-1 INHIBITORS MCL1, BCL2L1, BCL2 MVD 3068/4885HDAC6 178/4885HDAC1 204/4885
US-10703733-B2 MCL-1 inhibitors MCL1, BCL2L1, BCL2 MVD 3068/4885HDAC6 178/4885HDAC1 204/4885
US-11643400-B2 MCL-1 inhibitors MCL1, BCL2L1, BCL2 MVD 3068/4885HDAC6 178/4885HDAC1 204/4885
US-10988451-B2 MCL-1 inhibitors MCL1, BCL2L1, BCL2 MVD 3068/4885HDAC6 178/4885HDAC1 204/4885
US-20220340535-A1 MCL-1 INHIBITORS MCL1, BCL2L1, BCL2 MVD 3068/4885HDAC6 178/4885HDAC1 204/4885

“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.