SCHEMBL25912811

SCHEMBL25912811

CC1CN(C(=O)OC(C)(C)C)[C@@H](c2cccs2)CN1C(=O)OC(C)(C)C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.42
▸ BRD4 O60885 4/20 0.40
▸ KDM4E B2RXH2 3/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ MAPT P10636 3/20 0.39
▸ ALOX15 P16050 2/20 0.39
▸ HSD17B10 Q99714 2/20 0.39
▸ GAA P10253 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ TP53 P04637 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ CASP1 P29466 1/20 0.39
▸ BRDT Q58F21 1/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ GPR119 Q8TDV5 2/20 0.39
▸ POLB P06746 1/20 0.39

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
SCHEMBL25325918 1.00 ALDH1A1 (0.42) ALDH1A1BRD4KDM4ESMN1; SMN2MAPT
SCHEMBL30522965 0.78 NR1I2 (0.42) ALDH1A1KDM4EHSD17B10GAAHPGD
SCHEMBL13936174 0.77 PDK1 (0.43) ALDH1A1KDM4ESMN1; SMN2ALOX15HSD17B10
SCHEMBL4494042 0.77 PDK1 (0.43) ALDH1A1KDM4ESMN1; SMN2ALOX15HSD17B10
SCHEMBL25250111 0.77 ALDH1A1 (0.44) ALDH1A1BRD4KDM4ESMN1; SMN2MAPT
SCHEMBL31283533 0.76 KDM4E (0.42) ALDH1A1BRD4KDM4ESMN1; SMN2MAPT
SCHEMBL271429 0.74 TSHR (0.56) SMN1; SMN2MAPTHSD17B10TSHRGPR119
SCHEMBL527701 0.74 TSHR (0.56) SMN1; SMN2MAPTHSD17B10TSHRGPR119
SCHEMBL344752 0.74 TSHR (0.56) SMN1; SMN2MAPTHSD17B10TSHRGPR119
SCHEMBL25326986 0.73 NR1H2 (0.48) GPR119POLB

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-2023146991-A1 COMPOUNDS AND METHODS OF USE TANGO THERAPEUTICS, INC. (US) 2023-08-03 — — WO disclosed
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