SCHEMBL23924940

SCHEMBL23924940

O=C[CH]c1ccccc1C1CC1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 6/20 0.37
THRB P10828 2/20 0.37
LMNA P02545 2/20 0.37
MEN1 O00255 1/20 0.37
BLM P54132 1/20 0.37
KMT2A Q03164 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
TSHR P16473 2/20 0.35
ALDH1A1 P00352 1/20 0.35
HCAR1 Q9BXC0 2/20 0.33
HSD17B10 Q99714 2/20 0.32
PDK2 Q15119 1/20 0.32
PDK4 Q16654 1/20 0.32
CDK4 P11802 1/20 0.31
CCND1 P24385 1/20 0.31
TRIM24 O15164 1/20 0.31
TRIM33 Q9UPN9 1/20 0.31
CYP1A2 P05177 1/20 0.31
HTR1A P08908 1/20 0.31
ADRA2A P08913 1/20 0.31

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
SCHEMBL548147 0.83 LMNA (0.52) HTR2CTHRBLMNAMEN1BLM
SCHEMBL548161 0.77 LMNA (0.50) HTR2CTHRBLMNAMEN1BLM
SCHEMBL31415807 0.75 LMNA (0.48) HTR2CTHRBLMNAMEN1BLM
SCHEMBL547607 0.75 LMNA (0.48) HTR2CTHRBLMNAMEN1BLM
SCHEMBL6764461 0.75 MEN1 (0.43) THRBLMNAMEN1BLMKMT2A
SCHEMBL7792621 0.75 LMNA (0.43) HTR2CTHRBLMNAMEN1BLM
SCHEMBL12212996 0.75 LMNA (0.43) HTR2CTHRBLMNAMEN1BLM
SCHEMBL28958240 0.74 ALDH1A1 (0.43) HTR2CTHRBLMNATSHRALDH1A1
SCHEMBL28956588 0.74 HTR2C (0.35) HTR2CTHRBLMNATSHRHCAR1
SCHEMBL2913532 0.74 HTR2C (0.44) HTR2CTHRBLMNATSHRHSD17B10

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-4136084-A1 BCL-2 INHIBITOR BeiGene, Ltd. (KY) 2023-02-22 EP disclosed
WO-2021208963-A1 BCL-2 INHIBITOR BEIGENE, LTD. (KY) 2021-10-21 WO disclosed