SCHEMBL23304665

SCHEMBL23304665

CC(C)(C)OC(=O)c1cc(Br)nc(N2CCN(C(=O)C3CC3)CC2)c1.O=C(C1CC1)N1CCNCC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CHRNB2 P17787 1/20 0.41
▸ CHRNA3 P32297 1/20 0.41
▸ CHRNA4 P43681 1/20 0.41
▸ CHRNB3 Q05901 1/20 0.41
▸ CHRNA6 Q15825 1/20 0.41
▸ GBA1 P04062 1/20 0.39
▸ CKS1B P61024 2/20 0.36
▸ SKP1 P63208 2/20 0.36
▸ SKP2 Q13309 2/20 0.36
▸ ACACB O00763 1/20 0.36
▸ ACACA Q13085 1/20 0.36
▸ MTNR1B P49286 1/20 0.36
▸ MAPT P10636 5/20 0.35
▸ TP53 P04637 4/20 0.35
▸ LMNA P02545 1/20 0.35
▸ KHK P50053 1/20 0.35
▸ PTK6 Q13882 1/20 0.35
▸ HPGD P15428 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ GPR119 Q8TDV5 2/20 0.34

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
SCHEMBL30260122 0.94 GBA1 (0.43) GBA1CKS1BSKP1SKP2MTNR1B
SCHEMBL23684218 0.94 GBA1 (0.43) GBA1CKS1BSKP1SKP2MTNR1B
SCHEMBL23329785 0.81 GBA1 (0.43) GBA1CKS1BSKP1SKP2MTNR1B
SCHEMBL23304371 0.81 GBA1 (0.43) GBA1CKS1BSKP1SKP2MAPT
SCHEMBL23304383 0.80 NPC1 (0.41) GBA1CKS1BSKP1SKP2MAPT
SCHEMBL23304453 0.80 GBA1 (0.35) GBA1CKS1BSKP1SKP2MTNR1B
SCHEMBL23304587 0.79 HRH4 (0.41) MAPTTP53
SCHEMBL23684405 0.78 MAP4K4 (0.39) GBA1CKS1BSKP1SKP2MAPT
SCHEMBL23304303 0.77 HTR2A (0.40) GBA1CKS1BSKP1SKP2MAPT
SCHEMBL30260181 0.77 HTR2A (0.40) GBA1CKS1BSKP1SKP2MAPT

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-2021086879-A1 COMPOUNDS AND METHODS OF USE TANGO THERAPEUTICS, INC. (US) 2021-05-06 — — WO disclosed
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