SCHEMBL31344650

SCHEMBL31344650

CC(C)(C)OC(=O)c1ccc(N2CCN(Cc3ccccc3-c3ccc(Cl)cc3)CC2)cc1Oc1cnc2[nH]ccc2c1

nearest known ligand 0.59

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ BCL2 P10415 10/20 0.59
▸ BCL2L1 Q07817 2/20 0.57
▸ BCL2A1 Q16548 3/20 0.53
▸ BID P55957 2/20 0.53
▸ MCL1 Q07820 2/20 0.53
▸ ADRA1D P25100 1/20 0.50
▸ DRD3 P35462 1/20 0.50
▸ SLC6A3 Q01959 1/20 0.50
▸ TMEM97 Q5BJF2 1/20 0.50

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
SCHEMBL1702073 1.00 BCL2 (0.59) BCL2BCL2L1BCL2A1BIDMCL1
SCHEMBL2723710 0.97 BCL2 (0.56) BCL2BCL2L1BCL2A1BIDMCL1
SCHEMBL31450632 0.93 BCL2 (0.61) BCL2BCL2L1BCL2A1BIDMCL1
SCHEMBL26648191 0.93 BCL2 (0.61) BCL2BCL2L1BCL2A1BIDMCL1
SCHEMBL31450744 0.91 BCL2A1 (0.63) BCL2BCL2L1BCL2A1BIDMCL1
SCHEMBL1701594 0.91 BCL2A1 (0.63) BCL2BCL2L1BCL2A1BIDMCL1
SCHEMBL31450861 0.88 BCL2 (0.54) BCL2BCL2L1BCL2A1BIDMCL1
SCHEMBL26648210 0.88 BCL2 (0.54) BCL2BCL2L1BCL2A1BIDMCL1
SCHEMBL31450616 0.86 BCL2A1 (0.58) BCL2BCL2L1BCL2A1BIDMCL1
SCHEMBL26647890 0.86 BCL2A1 (0.58) BCL2BCL2L1BCL2A1BIDMCL1

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
EP-4474383-A2 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES AbbVie Ireland Unlimited Company (IE) 2024-12-11 — — EP disclosed
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