SCHEMBL28166409

SCHEMBL28166409

CCc1nc(OCc2ccccc2)c(C(=O)OC)cc1C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 4/20 0.53
PPARG P37231 1/20 0.47
LMNA P02545 1/20 0.46
HPGD P15428 1/20 0.46
MCL1 Q07820 1/20 0.46
BAK1 Q16611 1/20 0.46
L3MBTL1 Q9Y468 3/20 0.43
PKM P14618 1/20 0.43
RAB9A P51151 2/20 0.42
NPC1 O15118 1/20 0.42
KMT2A Q03164 1/20 0.42
CTSV O60911 2/20 0.41
CTSL P07711 2/20 0.41
MAPT P10636 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
SLC16A3 O15427 1/20 0.40
TSHR P16473 1/20 0.40
CASP3 P42574 1/20 0.40
SENP8 Q96LD8 1/20 0.40
SENP7 Q9BQF6 1/20 0.40

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
SCHEMBL16616609 0.95 CNR1 (0.55) CNR1PPARGLMNAHPGDMCL1
SCHEMBL16616128 0.91 MCL1 (0.50) CNR1PPARGMCL1BAK1L3MBTL1
SCHEMBL28848476 0.91 CNR1 (0.49) CNR1PPARGLMNAHPGDMCL1
SCHEMBL16616554 0.85 CNR1 (0.51) CNR1PPARGLMNAHPGDMCL1
SCHEMBL16624313 0.85 CNR1 (0.53) CNR1PPARGLMNAHPGDMCL1
SCHEMBL16616436 0.82 CNR1 (0.54) CNR1LMNAHPGDMCL1BAK1
SCHEMBL16616669 0.81 MCL1 (0.48) CNR1PPARGMCL1BAK1L3MBTL1
SCHEMBL16624284 0.79 CNR1 (0.52) CNR1LMNAHPGDMCL1BAK1
SCHEMBL4184727 0.78 GABRP (0.47) HPGDL3MBTL1RAB9ANPC1KMT2A
SCHEMBL16616165 0.78 CNR1 (0.51) CNR1LMNAHPGDMCL1BAK1

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
CN-105612158-B The somatostatin receptor hypotype 5 (SSTR5) antagonist 武田药品工业株式会社 2017-06-30 CN disclosed