SCHEMBL21576677

SCHEMBL21576677

C1CN2CCN(CC3CNC3)C[C@H]2CO1

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 1/20 0.30
CYP3A4 P08684 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
SCHEMBL24159230 0.79 KDM4E (0.32)
SCHEMBL24802750 0.76 SMN1; SMN2 (0.31) PIK3CDCYP3A4
SCHEMBL21576549 0.76 SMN1; SMN2 (0.31)
SCHEMBL22193066 0.76 SMN1; SMN2 (0.37) PIK3CD
SCHEMBL21675901 0.75 GAA (0.33) PIK3CDCYP3A4
SCHEMBL3478137 0.75 GAA (0.33) PIK3CDCYP3A4
SCHEMBL21688341 0.75 GAA (0.33) PIK3CDCYP3A4
Hydrochloric Acid SCHEMBL21570154 0.75 SMN1; SMN2 (0.30)
SCHEMBL25378830 0.72 SMN1; SMN2 (0.32)
SCHEMBL19159637 0.72 DRD3 (0.34)

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 9 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
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 PIK3CD 831/4885CYP3A4 4737/4885
US-20200331870-A1 MCL-1 INHIBITORS MCL1, BCL2L1, BCL2 PIK3CD 831/4885CYP3A4 4737/4885
US-20230312490-A1 MCL-1 INHIBITORS MCL1, BCL2L1, BCL2 PIK3CD 831/4885CYP3A4 4737/4885
US-10703733-B2 MCL-1 inhibitors MCL1, BCL2L1, BCL2 PIK3CD 831/4885CYP3A4 4737/4885
US-11643400-B2 MCL-1 inhibitors MCL1, BCL2L1, BCL2 PIK3CD 831/4885CYP3A4 4737/4885
US-10988451-B2 MCL-1 inhibitors MCL1, BCL2L1, BCL2 PIK3CD 831/4885CYP3A4 4737/4885

“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.