SCHEMBL30984839

SCHEMBL30984839

O=C1CCC(c2cc(C(=O)N3CCC4(CCC(CO)CC4)CC3)ccc2Cl)C(=O)N1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DDB1 Q16531 1/20 0.38
▸ CRBN Q96SW2 1/20 0.38
▸ GABRD O14764 2/20 0.36
▸ GABRA1 P14867 2/20 0.36
▸ GABRB1 P18505 2/20 0.36
▸ GABRA5 P31644 2/20 0.36
▸ GABRA3 P34903 2/20 0.36
▸ GABRA2 P47869 2/20 0.36
▸ GABRB2 P47870 2/20 0.36
▸ GABRA4 P48169 2/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ MGLL Q99685 1/20 0.36
▸ ITGB3 P05106 1/20 0.36
▸ ITGA2B P08514 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ ENPP2 Q13822 1/20 0.35
▸ ATXN2 Q99700 1/20 0.35
▸ FFAR4 Q5NUL3 1/20 0.35
▸ HTR1A P08908 1/20 0.35

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
SCHEMBL30984936 0.87 DDB1 (0.38) DDB1CRBNGABRDGABRA1GABRB1
SCHEMBL30984774 0.83 CCR3 (0.37) DDB1CRBNPOLB
SCHEMBL27123091 0.76 MGLL (0.38) DDB1CRBNMGLLITGB3ITGA2B
SCHEMBL24778021 0.76 GABRD (0.48) GABRDGABRA1GABRB1GABRA5GABRA3
SCHEMBL30014144 0.75 GABRD (0.45) DDB1CRBNGABRDGABRA1GABRB1
SCHEMBL30985168 0.74 CRBN (0.49) DDB1CRBN
SCHEMBL27123730 0.74 GABRD (0.43) DDB1CRBNGABRDGABRA1GABRB1
SCHEMBL29893498 0.73 FFAR4 (0.45) KMT2AMGLLFFAR4
SCHEMBL27118484 0.73 FFAR4 (0.45) KMT2AMGLLFFAR4
SCHEMBL28978035 0.72 DDB1 (0.44) DDB1CRBNKMT2AMGLLHPGD

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-2024146502-A1 WEE1 DEGRADING COMPOUNDS BEIJING NEOX BIOTECH LIMITED (CN) 2024-07-11 — — WO disclosed
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