SCHEMBL21150818

SCHEMBL21150818

CNC1(C(=O)N(C=O)c2ccccc2)CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.44
ALOX15 P16050 1/20 0.44
ATM Q13315 1/20 0.44
GPR119 Q8TDV5 1/20 0.41
KDM4E B2RXH2 1/20 0.40
PKM P14618 1/20 0.40
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
TACR1 P25103 1/20 0.39
OPRD1 P41143 1/20 0.39
OPRK1 P41145 1/20 0.39
STS P08842 1/20 0.39
NAMPT P43490 1/20 0.39
USP30 Q70CQ3 2/20 0.38
PTPRB P23467 1/20 0.38
PTPN11 Q06124 1/20 0.38
JAK2 O60674 1/20 0.38
JAK1 P23458 1/20 0.38

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
SCHEMBL21150835 0.88 NR1H2 (0.39) TSHRALOX15ATMGPR119MEN1
SCHEMBL21150851 0.85 GPR119 (0.39) TSHRALOX15ATMGPR119MEN1
SCHEMBL21152108 0.80 POLB (0.34) KDM4EPKMPTPRBPTPN11
SCHEMBL3489718 0.76 TSHR (0.45) TSHRALOX15ATMGPR119KDM4E
SCHEMBL21152096 0.75 OPRM1 (0.43) KDM4EMEN1KMT2AOPRD1OPRK1
SCHEMBL17140845 0.74 GPR119 (0.51) TSHRALOX15ATMGPR119KDM4E
SCHEMBL14346584 0.72 ALDH1A1 (0.39) TSHRALOX15GPR119STSNAMPT
SCHEMBL17848498 0.72 GPR119 (0.48) TSHRALOX15ATMGPR119KDM4E
SCHEMBL5726017 0.72 TSHR (0.44) TSHRALOX15ATMGPR119KDM4E
SCHEMBL4443471 0.70 USP2 (0.46) TSHRALOX15ATMGPR119KDM4E

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-2019136442-A1 CD16A BINDING AGENTS AND USES THEREOF KLEO PHARMACEUTICALS, INC. (US) 2019-07-11 WO disclosed