SCHEMBL28521153

SCHEMBL28521153

CC(C)Oc1ccccc1C1CCCN1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.49
▸ KMT2A Q03164 2/20 0.49
▸ TACR1 P25103 2/20 0.46
▸ ATM Q13315 1/20 0.46
▸ ADRA2A P08913 6/20 0.42
▸ ADRA2B P18089 6/20 0.42
▸ ADRA2C P18825 6/20 0.42
▸ HTR1A P08908 2/20 0.41
▸ TAAR1 Q96RJ0 1/20 0.41
▸ HTR2A P28223 1/20 0.40
▸ HTR2C P28335 1/20 0.40
▸ HTR2B P41595 1/20 0.40
▸ CHRNB4 P30926 1/20 0.39
▸ CHRNA3 P32297 1/20 0.39
▸ NISCH Q9Y2I1 1/20 0.39
▸ HSD11B1 P28845 1/20 0.39

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
SCHEMBL28521149 1.00 MEN1 (0.49) MEN1KMT2ATACR1ATMADRA2A
SCHEMBL25289106 0.95 ATM (0.45) MEN1KMT2ATACR1ATMADRA2A
SCHEMBL25247513 0.95 ATM (0.45) MEN1KMT2ATACR1ATMADRA2A
SCHEMBL25238785 0.95 ATM (0.45) MEN1KMT2ATACR1ATMADRA2A
SCHEMBL31198369 0.84 TACR1 (0.46) MEN1KMT2ATACR1ADRA2AADRA2B
SCHEMBL16796794 0.84 TACR1 (0.46) MEN1KMT2ATACR1ADRA2AADRA2B
SCHEMBL23323077 0.82 MEN1 (0.65) MEN1KMT2ATACR1HTR2CCHRNB4
SCHEMBL469013 0.82 MEN1 (0.65) MEN1KMT2ATACR1HTR2CCHRNB4
SCHEMBL29589447 0.82 MEN1 (0.65) MEN1KMT2ATACR1HTR2CCHRNB4
SCHEMBL25238033 0.80 HTR2A (0.48) MEN1KMT2AATMADRA2AADRA2B

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
CN-117683029-A Bcl-2 inhibitors 百济神州有限公司 2024-03-12 — — 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
CN-112437772-A Bcl-2 inhibitors 百济神州有限公司 2021-03-02 — — CN disclosed
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