SCHEMBL16038822

SCHEMBL16038822

CN(c1ccc(S(=O)(=O)NC(=O)c2ccc(N3CCN(CC4=C(c5ccc(Cl)c(F)c5)CC(C)(C)CC4)CC3)cc2Oc2cnc3[nH]ccc3c2)cc1[N+](=O)[O-])C1CCOCC1

nearest known ligand 0.75

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ BCL2 P10415 20/20 0.75
▸ BCL2L1 Q07817 8/20 0.73
▸ NSD2 O96028 1/20 0.73
▸ ADORA3 P0DMS8 1/20 0.73
▸ CYP2C9 P11712 1/20 0.73
▸ ADRA2C P18825 1/20 0.73
▸ SLC6A2 P23975 1/20 0.73
▸ BID P55957 1/20 0.73
▸ SLC6A3 Q01959 1/20 0.73
▸ MCL1 Q07820 1/20 0.73
▸ ASPH Q12797 1/20 0.73
▸ BCL2L2 Q92843 1/20 0.73
▸ BAD Q92934 1/20 0.73
▸ NSD1 Q96L73 1/20 0.73
▸ NSD3 Q9BZ95 1/20 0.73

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
SCHEMBL16038586 0.96 BCL2 (0.77) BCL2BCL2L1NSD2ADORA3CYP2C9
SCHEMBL15991888 0.94 BCL2 (0.82) BCL2BCL2L1NSD2ADORA3CYP2C9
SCHEMBL16039278 0.92 BCL2 (0.75) BCL2BCL2L1NSD2ADORA3CYP2C9
SCHEMBL16037936 0.92 BCL2 (0.75) BCL2BCL2L1NSD2ADORA3CYP2C9
SCHEMBL16038819 0.91 BCL2 (0.89) BCL2BCL2L1NSD2ADORA3CYP2C9
SCHEMBL1701880 0.90 BCL2 (0.78) BCL2BCL2L1NSD2ADORA3CYP2C9
SCHEMBL28621835 0.89 BCL2 (0.81) BCL2BCL2L1NSD2ADORA3CYP2C9
SCHEMBL1702213 0.89 BCL2 (0.81) BCL2BCL2L1NSD2ADORA3CYP2C9
SCHEMBL1701830 0.89 BCL2 (0.76) BCL2BCL2L1NSD2ADORA3CYP2C9
SCHEMBL1808763 0.88 BCL2 (0.81) BCL2BCL2L1NSD2ADORA3CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210403467-A1 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES ABBVIE INC (US) 2021-12-30 — — US disclosed
CN-107987075-B Apoptosis-inducing agents for the treatment of cancer and immune and autoimmune diseases 艾伯维公司 2020-12-01 — — CN disclosed
US-20200331907-A1 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES ABBVIE INC (US) 2020-10-22 — — US disclosed
EP-3415514-A1 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES AbbVie Inc. (US) 2018-12-19 — — EP disclosed
US-20180354952-A1 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES ABBVIE INC. 2018-12-13 — — US disclosed
US-10081628-B2 Apoptosis-inducing agents for the treatment of cancer and immune and autoimmune diseases ABBVIE INC. (US) 2018-09-25 — — US disclosed
EP-2970257-B1 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES ABBVIE INC (US) 2018-05-30 — — EP disclosed
US-20170008891-A1 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES ABBVIE INC. 2017-01-12 — — US disclosed
EP-2970257-A1 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES AbbVie Inc. (US) 2016-01-20 — — EP disclosed
US-20150299197-A1 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES ABBVIE INC. 2015-10-22 — — US disclosed
WO-2014158528-A1 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES ABBVIE INC. (US) 2014-10-02 — — WO disclosed
US-20140275082-A1 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES ABBVIE INC. 2014-09-18 — — US disclosed
Send feedback