SCHEMBL29657435

SCHEMBL29657435

CN1CCC(CNc2ccc(S(=O)(=O)NC(=O)c3ccccc3Oc3cnc4[nH]ccc4c3)cc2[N+](=O)[O-])CC1

nearest known ligand 0.72

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ BCL2 P10415 20/20 0.72
▸ BCL2L1 Q07817 15/20 0.72
▸ CYP2C9 P11712 1/20 0.72

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
SCHEMBL29796424 0.93 BCL2 (0.68) BCL2BCL2L1
SCHEMBL20580490 0.92 BCL2 (0.69) BCL2BCL2L1CYP2C9
SCHEMBL1871052 0.91 BCL2 (0.74) BCL2BCL2L1
SCHEMBL29403314 0.91 BCL2 (0.74) BCL2BCL2L1
SCHEMBL30313967 0.91 BCL2 (0.69) BCL2BCL2L1
SCHEMBL30314089 0.91 BCL2 (0.68) BCL2BCL2L1CYP2C9
SCHEMBL2724283 0.91 BCL2 (0.66) BCL2BCL2L1
SCHEMBL29796248 0.91 BCL2 (0.65) BCL2BCL2L1
SCHEMBL29796310 0.91 BCL2 (0.66) BCL2BCL2L1
SCHEMBL1868680 0.91 BCL2 (0.65) 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4243857-A1 COMBINATION THERAPIES WITH CHIMERIC ANTIGEN RECEPTOR (CAR)-EXPRESSING CELLS Novartis AG (CH) 2023-09-20 — — EP disclosed
CN-116635062-A Combination therapy using Chimeric Antigen Receptor (CAR) expressing cells 诺华股份有限公司 2023-08-22 — — CN disclosed
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
WO-2022104061-A1 COMBINATION THERAPIES WITH CHIMERIC ANTIGEN RECEPTOR (CAR)-EXPRESSING CELLS NOVARTIS AG (CH) 2022-05-19 — — WO disclosed
Send feedback