SCHEMBL25786233

SCHEMBL25786233

COC(=O)c1c(C)c2c(-c3c(CO)nn(C)c3C)c(C)ccc2n1CCCOc1cc(C)cc2cc(F)ccc12

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BAD Q92934 8/20 0.37
BCL2 P10415 4/20 0.37
MCL1 Q07820 9/20 0.36
PMAIP1 Q13794 6/20 0.36
BCL2L1 Q07817 7/20 0.34
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
HPGD P15428 1/20 0.34
HSD17B10 Q99714 1/20 0.34
MARK3 P27448 3/20 0.33
GSK3B P49841 3/20 0.33
CAMK2B Q13554 3/20 0.33
MARK2 Q7KZI7 3/20 0.33
MINK1 Q8N4C8 3/20 0.33
SRPK1 Q96SB4 3/20 0.33
HIPK2 Q9H2X6 3/20 0.33
SYK P43405 2/20 0.33
PLK1 P53350 2/20 0.33
PLK3 Q9H4B4 2/20 0.33
CDC7 O00311 2/20 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
SCHEMBL25786231 0.94 MCL1 (0.40) BADBCL2MCL1PMAIP1BCL2L1
SCHEMBL25786224 0.93 BAD (0.43) BADBCL2MCL1PMAIP1BCL2L1
SCHEMBL25793459 0.93 BAD (0.35) BADBCL2MCL1PMAIP1BCL2L1
SCHEMBL25786617 0.88 BAD (0.45) BADBCL2MCL1PMAIP1BCL2L1
SCHEMBL25786229 0.88 BAD (0.42) BADBCL2MCL1PMAIP1BCL2L1
SCHEMBL25297623 0.87 MAPT (0.33) BADBCL2MCL1PMAIP1BCL2L1
SCHEMBL29897113 0.87 MAPT (0.33) BADBCL2MCL1PMAIP1BCL2L1
SCHEMBL25786253 0.86 BAD (0.40) BADBCL2MCL1PMAIP1BCL2L1
SCHEMBL25786228 0.85 BAD (0.38) BADBCL2MCL1PMAIP1BCL2L1
SCHEMBL25786248 0.85 BAD (0.41) BADBCL2MCL1PMAIP1BCL2L1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11691989-B2 Macrocyclic indoles as Mcl-1 inhibitors ASCENTAGE PHARMA (SUZHOU) CO., LTD. (CN) 2023-07-04 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 (1 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-11691989-B2 Macrocyclic indoles as Mcl-1 inhibitors MCL1, BCL2A1, BCL2L1 BAD 20/4885BCL2 10/4885MCL1 1/4885

“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.