SCHEMBL26050348

SCHEMBL26050348

CCCCN1CCC(C(=O)O)C1CC

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GBA2 Q9HCG7 8/20 0.47
GBA1 P04062 3/20 0.42
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
POLB P06746 1/20 0.38
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
KCNH2 Q12809 1/20 0.36
OGA O60502 1/20 0.35
UGCG Q16739 3/20 0.35
MGAM O43451 2/20 0.35
GAA P10253 2/20 0.35
SI P14410 2/20 0.35
AGL P35573 2/20 0.35
NR1I2 O75469 1/20 0.35
ALDH1A1 P00352 1/20 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
SCHEMBL9340416 0.90 GBA2 (0.42) GBA2GBA1MEN1KMT2APOLB
SCHEMBL26050252 0.90 GBA1 (0.45) GBA2GBA1
SCHEMBL4083012 0.84 GBA2 (0.43) GBA2GBA1MEN1KMT2APOLB
SCHEMBL4518775 0.81 BCHE (0.37) GBA2KCNH2NR1I2ALDH1A1
SCHEMBL21618579 0.78 POLB (0.35) POLB
SCHEMBL9863071 0.75 GBA1 (0.48) GBA2GBA1KCNH2
SCHEMBL5701883 0.75 GBA2 (0.45) GBA2GBA1MEN1KMT2APOLB
SCHEMBL5702265 0.75 GBA2 (0.45) GBA2GBA1MEN1KMT2APOLB
SCHEMBL5015303 0.74 GBA1 (0.41) GBA2GBA1
SCHEMBL4523595 0.74 SMN1; SMN2 (0.37) GBA2MEN1KMT2AALDH1A1

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
EP-4234030-A2 PD-1/PD-L1 INHIBITORS Gilead Sciences, Inc. (US) 2023-08-30 EP disclosed