SCHEMBL2498869

SCHEMBL2498869

CC1(C)CCC(c2ccc(Cl)cc2)=C(CN2CCN(c3cccc(Cn4c(=NC(=O)OC(C)(C)C)n(CCCOc5cccc(C(=O)O)c5)c5ccccc54)c3)CC2)C1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
BCL2L1 Q07817 9/20 0.50
BCL2 P10415 16/20 0.42
BCL2L11 O43521 1/20 0.38
CYP2C9 P11712 1/20 0.38
MCL1 Q07820 1/20 0.38
ASPH Q12797 1/20 0.38
BCL2L2 Q92843 1/20 0.38
BAD Q92934 1/20 0.38

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
SCHEMBL2498862 1.00 BCL2L1 (0.50) BCL2L1BCL2BCL2L11CYP2C9MCL1
SCHEMBL2493656 0.89 BCL2L1 (0.54) BCL2L1BCL2
SCHEMBL13332630 0.88 BCL2L1 (0.45) BCL2L1BCL2BCL2L11CYP2C9MCL1
SCHEMBL2493411 0.77 BCL2L1 (0.45) BCL2L1BCL2
SCHEMBL13332632 0.76 BCL2L1 (0.48) BCL2L1BCL2BCL2L11CYP2C9MCL1
SCHEMBL2494348 0.75 MRGPRX4 (0.42) BCL2MCL1
SCHEMBL15826886 0.75 MRGPRX4 (0.42) BCL2MCL1
SCHEMBL2494352 0.75 MRGPRX4 (0.42) BCL2MCL1
SCHEMBL2496992 0.75 BCL2L1 (0.55) BCL2L1BCL2BCL2L11CYP2C9MCL1
SCHEMBL2493081 0.70 BCL2L1 (0.51) BCL2L1BCL2

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-8759520-B2 Compounds for treating cancer BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-06-24 US disclosed
EP-2373629-B1 COMPOUNDS FOR TREATING CANCER BOEHRINGER INGELHEIM INT (DE) 2013-04-10 EP disclosed
US-20110312969-A1 COMPOUNDS FOR TREATING CANCER BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-12-22 US disclosed
EP-2373629-A1 COMPOUNDS FOR TREATING CANCER BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-10-12 EP disclosed
WO-2010067067-A1 COMPOUNDS FOR TREATING CANCER EVOTEC AG (DE) 2010-06-17 WO 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-20110312969-A1 COMPOUNDS FOR TREATING CANCER BCL2, BAX, BCL2A1 BCL2L1 5/4885BCL2 1/4885BCL2L11 9/4885

“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.