SCHEMBL24615892

SCHEMBL24615892

COCC(O)c1cccc(Cl)c1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.50
SLC6A4 P31645 1/20 0.50
SLC6A3 Q01959 1/20 0.50
ADRB3 P13945 8/20 0.47
ADRB1 P08588 7/20 0.47
ADRB2 P07550 6/20 0.47
HPGD P15428 1/20 0.47
AOC3 Q16853 1/20 0.46
SLC2A1 P11166 3/20 0.46
GLA P06280 1/20 0.43
IDO1 P14902 2/20 0.42
PYGL P06737 1/20 0.41

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
SCHEMBL14091149 1.00 SLC6A2 (0.50) SLC6A2SLC6A4SLC6A3ADRB3ADRB1
SCHEMBL20180124 0.86 ADRB3 (0.45) SLC6A2SLC6A4SLC6A3ADRB3ADRB1
SCHEMBL9195198 0.81 SLC6A4 (0.52) SLC6A2SLC6A4SLC6A3HPGDAOC3
SCHEMBL16759671 0.81 PYGL (0.39) SLC6A2SLC6A4SLC6A3ADRB1ADRB2
SCHEMBL1935468 0.80 AOC3 (0.45) SLC6A2SLC6A4SLC6A3ADRB3ADRB1
SCHEMBL17071836 0.80 SLC6A2 (0.51) SLC6A2SLC6A4SLC6A3ADRB3ADRB1
SCHEMBL16771184 0.80 SLC6A2 (0.51) SLC6A2SLC6A4SLC6A3ADRB3ADRB1
SCHEMBL16952699 0.80 SLC6A4 (0.51) SLC6A2SLC6A4SLC6A3HPGDAOC3
SCHEMBL25832940 0.80 SLC6A2 (0.51) SLC6A2SLC6A4SLC6A3ADRB3ADRB1
SCHEMBL3482675 0.79 LMNA (0.57) SLC6A2SLC6A4ADRB3ADRB1ADRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022148422-A1 BRIDGED COMPOUNDS AS KRAS G12D INHIBITOR AND DEGRADER AND THE USE THEREOF BEIGENE, LTD. (KY) 2022-07-14 WO disclosed