SCHEMBL20053618

SCHEMBL20053618

CC(C)(F)CN1CCC(COc2ccc(-c3ccc(C(=O)N4CCCC4)nc3)cc2F)CC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 4/20 0.41
WNT1 P04628 2/20 0.41
MGLL Q99685 3/20 0.40
TRPC6 Q9Y210 2/20 0.38
KMT2A Q03164 2/20 0.38
RAB9A P51151 3/20 0.38
NPC1 O15118 2/20 0.38
GSK3B P49841 2/20 0.38
NR3C1 P04150 1/20 0.38
PGR P06401 1/20 0.38
PRKAB2 O43741 1/20 0.38
PRKAG1 P54619 1/20 0.38
PRKAA2 P54646 1/20 0.38
PRKAA1 Q13131 1/20 0.38
PRKAG3 Q9UGI9 1/20 0.38
PRKAG2 Q9UGJ0 1/20 0.38
PRKAB1 Q9Y478 1/20 0.38
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
TDP1 Q9NUW8 1/20 0.37

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
SCHEMBL15539227 0.92 KMT2A (0.41) DYRK1AWNT1MGLLKMT2ARAB9A
SCHEMBL15539229 0.92 KMT2A (0.41) DYRK1AWNT1MGLLKMT2ARAB9A
SCHEMBL21535082 0.91 MGLL (0.40) DYRK1AWNT1MGLLTRPC6KMT2A
SCHEMBL15539556 0.89 DYRK1A (0.43) DYRK1AWNT1GSK3BRBP4
SCHEMBL20053637 0.89 XDH (0.45)
SCHEMBL15538437 0.88 DYRK1A (0.44) DYRK1AWNT1GSK3BRBP4
SCHEMBL20053541 0.88 SLC6A9 (0.41) RBP4
SCHEMBL15540280 0.86 CNR2 (0.45) DYRK1AWNT1
SCHEMBL15539372 0.86 CNR2 (0.45) DYRK1AWNT1
SCHEMBL20053606 0.86 HRH3 (0.42)

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2858986-B1 PIPERIDINE DERIVATIVES AS GPR119 AGONISTS CHONG KUN DANG PHARMACEUTICAL CORP (KR) 2019-10-30 EP disclosed
US-9944600-B2 Piperidine derivatives for GPR119 agonist CHONG KUN DANG PHARMACEUTICAL CORP. (KR) 2018-04-17 US disclosed