SCHEMBL31303343

SCHEMBL31303343

O=CCCCCOCC1CCNCC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 1/20 0.33
▸ SLC6A1 P30531 2/20 0.32
▸ GABRA5 P31644 2/20 0.32
▸ GABRB2 P47870 2/20 0.32
▸ SLC6A12 P48065 2/20 0.32
▸ SLC6A11 P48066 2/20 0.32
▸ SLC6A13 Q9NSD5 2/20 0.32
▸ GABRA1 P14867 1/20 0.32
▸ GABRR1 P24046 1/20 0.32
▸ GABRA4 P48169 1/20 0.32
▸ TSHR P16473 1/20 0.31
▸ SLC6A2 P23975 1/20 0.31
▸ SLC6A4 P31645 1/20 0.31
▸ HTR3A P46098 1/20 0.31
▸ KCNH2 Q12809 1/20 0.31
▸ HIF1A Q16665 1/20 0.31
▸ ITGB3 P05106 1/20 0.31
▸ ITGA2B P08514 1/20 0.31
▸ GNAI3 P08754 1/20 0.30
▸ GNAO1 P09471 1/20 0.30

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
SCHEMBL8741893 0.75 ITGB3 (0.36) SLC6A1GABRA5GABRB2SLC6A12SLC6A11
SCHEMBL3948570 0.75 ITGB3 (0.39) SLC6A1GABRA5GABRB2SLC6A12SLC6A11
SCHEMBL10750819 0.74 — —
SCHEMBL29256365 0.74 SLC1A3 (0.31) TSHR
SCHEMBL13610213 0.74 ALDH1A1 (0.52) TDP1GNAI3GNAO1GNAI1
SCHEMBL2846483 0.74 ALDH1A1 (0.52) TDP1GNAI3GNAO1GNAI1
SCHEMBL7512016 0.73 TDP1 (0.36) TDP1SLC6A1GABRA5GABRB2SLC6A12
SCHEMBL14395367 0.73 SMN1; SMN2 (0.48) TDP1TSHRSLC6A2SLC6A4HTR3A
SCHEMBL25028441 0.73 HIF1A (0.32) HIF1A
SCHEMBL27119127 0.72 TDP1 (0.38) TDP1SLC6A2SLC6A4HTR3AKCNH2

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-2024229393-A1 HPK1 DEGRADERS AND USES THEREOF Nimbus Saturn, Inc. (US) 2024-11-07 — — WO disclosed
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