SCHEMBL3766413

SCHEMBL3766413

Cc1ccc2c(CCc3ccccc3)c3ccccc3c(CCc3ccccc3)c2c1C

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ BCL2 P10415 1/20 0.39
▸ BCL2L1 Q07817 1/20 0.39
▸ MCL1 Q07820 1/20 0.39
▸ BCL2A1 Q16548 1/20 0.39
▸ CYP1A2 P05177 2/20 0.36
▸ CYP2A6 P11509 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ KCNH2 Q12809 2/20 0.35
▸ POLB P06746 1/20 0.34
▸ MEN1 O00255 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ MAOA P21397 1/20 0.33
▸ MAOB P27338 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ ABCG2 Q9UNQ0 1/20 0.33

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
SCHEMBL9770029 0.80 BCL2 (0.41) BCL2BCL2L1MCL1BCL2A1CYP2A6
SCHEMBL9770110 0.80 BCL2 (0.42) BCL2BCL2L1MCL1BCL2A1KCNH2
SCHEMBL419411 0.78 MAOA (0.50) CYP2A6KCNH2MAOAMAOBALDH1A1
SCHEMBL15412100 0.75 TSHR (0.41) CYP1A2CYP2A6TSHRMEN1KMT2A
SCHEMBL19019731 0.70 BCL2 (0.39) BCL2BCL2L1MCL1BCL2A1KCNH2
SCHEMBL10491650 0.70 KCNH2 (0.48) CYP1A2CYP2A6KCNH2POLBMAOA
SCHEMBL5843480 0.69 KIF11 (0.46) BCL2BCL2L1MCL1BCL2A1CYP1A2
SCHEMBL9782882 0.69 L3MBTL1 (0.48) CYP2A6KCNH2MAOAMAOBALDH1A1
SCHEMBL2723993 0.68 KCNH2 (0.48) BCL2BCL2L1MCL1BCL2A1CYP2A6
SCHEMBL10491806 0.67 BCL2 (0.45) BCL2BCL2L1MCL1BCL2A1CYP2A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11740238-B2 Compositions and methods of detecting a substance of interest PIONEER HI-BRED INTERNATIONAL, INC. 2023-08-29 — — US disclosed
US-20180252711-A1 COMPOSITIONS AND METHODS OF DETECTING A SUBSTANCE OF INTEREST PIONEER HI-BRED INTERNATIONAL, INC. (US) 2018-09-06 — — US disclosed
US-8486719-B2 Multiplex assay methods and compositions PERKINELMER BIOSIGNAL, INC. (CA) 2013-07-16 — — US disclosed
US-20100304403-A1 MULTIPLEX ASSAY METHODS AND COMPOSITIONS PERKINELMER BIOSIGNAL, INC. 2010-12-02 — — US disclosed
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