SCHEMBL29139955

SCHEMBL29139955

CCCCCCC(CC)OC(=O)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 2/20 0.56
PRKCD Q05655 2/20 0.56
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
ALDH1A1 P00352 1/20 0.51
PRSS1 P07477 3/20 0.49
PRSS2 P07478 1/20 0.49
PRSS3 P35030 1/20 0.49
PNLIP P16233 3/20 0.47
CTSK P43235 2/20 0.47
CES2 O00748 1/20 0.46
CES1 P23141 1/20 0.46
LMNA P02545 2/20 0.46
CTSG P08311 2/20 0.46
CTRB1 P17538 2/20 0.46
CMA1 P23946 2/20 0.46
TSHR P16473 2/20 0.46
ALOX12 P18054 1/20 0.46
NAAA Q02083 1/20 0.45
TP53 P04637 1/20 0.45

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
SCHEMBL29263163 1.00 PRKCA (0.56) PRKCAPRKCDMEN1KMT2AALDH1A1
SCHEMBL27414334 1.00 PRKCA (0.56) PRKCAPRKCDMEN1KMT2AALDH1A1
Hydrochloric Acid SCHEMBL28446579 0.98 PRKCA (0.55) PRKCAPRKCDMEN1KMT2AALDH1A1
SCHEMBL297352 0.98 PRKCA (0.57) PRKCAPRKCDMEN1KMT2AALDH1A1
Dimethylamine SCHEMBL18421239 0.94 PRKCA (0.53) PRKCAPRKCDMEN1KMT2AALDH1A1
SCHEMBL28452193 0.94 MEN1 (0.54) PRKCAPRKCDMEN1KMT2AALDH1A1
SCHEMBL1331116 0.94 MEN1 (0.54) PRKCAPRKCDMEN1KMT2AALDH1A1
SCHEMBL18489570 0.94 PRKCA (0.62) PRKCAPRKCDMEN1KMT2AALDH1A1
SCHEMBL28890372 0.94 MEN1 (0.54) PRKCAPRKCDMEN1KMT2AALDH1A1
SCHEMBL245922 0.94 MEN1 (0.54) PRKCAPRKCDMEN1KMT2AALDH1A1

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
CN-117835974-A Methods of treating B cell malignancies using BCL-2 inhibitors 百济神州有限公司 2024-04-05 CN disclosed
CN-117683029-A Bcl-2 inhibitors 百济神州有限公司 2024-03-12 CN disclosed
CN-117500499-A Substituted indole compounds and methods of use thereof 奇努克治疗公司 2024-02-02 CN disclosed
CN-117430601-A Bcl-2 inhibitors 百济神州有限公司 2024-01-23 CN disclosed
CN-112437772-B Bcl-2 inhibitors 百济神州有限公司 2023-11-21 CN disclosed