SCHEMBL29796424

SCHEMBL29796424

O=C(NS(=O)(=O)c1ccc(NCC2CCN(C3CC3)CC2)c([N+](=O)[O-])c1)c1ccccc1Oc1cnc2[nH]ccc2c1

nearest known ligand 0.68

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ BCL2 P10415 20/20 0.68
▸ BCL2L1 Q07817 6/20 0.67

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
SCHEMBL30313967 0.95 BCL2 (0.69) BCL2BCL2L1
SCHEMBL29657435 0.93 BCL2 (0.72) BCL2BCL2L1
SCHEMBL30314177 0.93 BCL2 (0.70) BCL2BCL2L1
SCHEMBL29657349 0.93 BCL2 (0.70) BCL2BCL2L1
SCHEMBL2725176 0.93 BCL2 (0.70) BCL2BCL2L1
SCHEMBL2727376 0.93 BCL2 (0.70) BCL2BCL2L1
SCHEMBL29944585 0.91 BCL2 (0.67) BCL2BCL2L1
SCHEMBL1871052 0.91 BCL2 (0.74) BCL2BCL2L1
SCHEMBL29403314 0.91 BCL2 (0.74) BCL2BCL2L1
SCHEMBL30314109 0.91 BCL2 (0.70) BCL2BCL2L1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114786679-A Combination therapy with Vernetork and TIM-3 inhibitors 诺华股份有限公司 2022-07-22 — — CN disclosed
CN-114786680-A TIM-3 inhibitors and uses thereof 诺华股份有限公司 2022-07-22 — — CN disclosed
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