SCHEMBL21576490

SCHEMBL21576490

COC(=O)[C@]1(C)C[C@H](N)C1

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
GABRR1 P24046 1/20 0.32
MMP2 P08253 1/20 0.32
ANPEP P15144 1/20 0.32
ALDH1A1 P00352 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
HTT P42858 1/20 0.31
APLNR P35414 1/20 0.30

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
SCHEMBL20690392 1.00 NPSR1 (0.33) NPSR1MEN1KMT2AGABRR1MMP2
SCHEMBL25554244 1.00 NPSR1 (0.33) NPSR1MEN1KMT2AGABRR1MMP2
Hydrochloric Acid SCHEMBL21570151 0.98 NPSR1 (0.32) NPSR1MEN1KMT2AGABRR1MMP2
Trifluoroacetic Acid SCHEMBL31196404 0.87
SCHEMBL30234161 0.86 ATM (0.33) ALDH1A1
SCHEMBL17064244 0.84 NPSR1 (0.33) NPSR1MEN1KMT2AALDH1A1L3MBTL1
SCHEMBL21496929 0.84 MEN1 (0.32) MEN1KMT2A
SCHEMBL2340412 0.84 NPSR1 (0.33) NPSR1MEN1KMT2AALDH1A1L3MBTL1
SCHEMBL2340414 0.84 NPSR1 (0.33) NPSR1MEN1KMT2AALDH1A1L3MBTL1
Hydrochloric Acid SCHEMBL17062254 0.82 NPSR1 (0.32) NPSR1MEN1KMT2AALDH1A1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-11643400-B2 MCL-1 inhibitors GILEAD SCIENCES, INC. (US) 2023-05-09 US 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
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-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 (6 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 NPSR1 4702/4885MEN1 1972/4885KMT2A 2456/4885
US-20200331870-A1 MCL-1 INHIBITORS MCL1, BCL2L1, BCL2 NPSR1 4702/4885MEN1 1972/4885KMT2A 2456/4885
US-20230312490-A1 MCL-1 INHIBITORS MCL1, BCL2L1, BCL2 NPSR1 4702/4885MEN1 1972/4885KMT2A 2456/4885
US-10703733-B2 MCL-1 inhibitors MCL1, BCL2L1, BCL2 NPSR1 4702/4885MEN1 1972/4885KMT2A 2456/4885
US-11643400-B2 MCL-1 inhibitors MCL1, BCL2L1, BCL2 NPSR1 4702/4885MEN1 1972/4885KMT2A 2456/4885
US-10988451-B2 MCL-1 inhibitors MCL1, BCL2L1, BCL2 NPSR1 4702/4885MEN1 1972/4885KMT2A 2456/4885

“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.