SCHEMBL3664399

SCHEMBL3664399

O=C(NS(=O)(=O)c1cccc(S(=O)(=O)C(F)(F)F)c1)c1ccc(N2CCN(CC3=C(c4ccc(Cl)cc4)CCOC3)CC2)cc1

nearest known ligand 0.65

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ BCL2 P10415 19/20 0.65
▸ BCL2L1 Q07817 15/20 0.65
▸ BCL2L2 Q92843 2/20 0.54
▸ BCL2L11 O43521 1/20 0.54
▸ CYP2C9 P11712 1/20 0.54
▸ MCL1 Q07820 1/20 0.54
▸ ASPH Q12797 1/20 0.54
▸ BAD Q92934 1/20 0.54

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
SCHEMBL5307598 0.90 BCL2L1 (0.62) BCL2BCL2L1BCL2L2BCL2L11CYP2C9
SCHEMBL19425151 0.89 BCL2 (0.65) BCL2BCL2L1BCL2L2BCL2L11CYP2C9
SCHEMBL30286306 0.86 BCL2 (0.67) BCL2BCL2L1BCL2L2BCL2L11CYP2C9
SCHEMBL19425230 0.84 BCL2 (0.68) BCL2BCL2L1BCL2L2BCL2L11CYP2C9
SCHEMBL19425293 0.82 BCL2 (0.64) BCL2BCL2L1BCL2L2BCL2L11CYP2C9
SCHEMBL19425235 0.82 BCL2 (0.57) BCL2BCL2L1BCL2L2BCL2L11CYP2C9
SCHEMBL1627395 0.80 BCL2L1 (0.83) BCL2BCL2L1BCL2L2BCL2L11CYP2C9
SCHEMBL2022459 0.80 BCL2 (0.79) BCL2BCL2L1BCL2L2BCL2L11CYP2C9
SCHEMBL2024130 0.80 BCL2 (0.82) BCL2BCL2L1BCL2L2BCL2L11CYP2C9
SCHEMBL2025716 0.79 BCL2 (0.76) BCL2BCL2L1BCL2L2BCL2L11CYP2C9

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
EP-2231159-A1 METHOD OF TREATING ARTHRITIS Abbott Laboratories (US) 2010-09-29 — — EP disclosed
WO-2009064938-A1 METHOD OF TREATING ARTHRITIS ABBOTT LABORATORIES (US) 2009-05-22 — — WO disclosed
Send feedback