SCHEMBL28401115

SCHEMBL28401115

CNc1ccc(C2CCN(C(=O)OC(C)(C)C)CC2)cn1

nearest known ligand 0.69

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 1/20 0.69
CRBN Q96SW2 1/20 0.69
WNT3A P56704 1/20 0.58
NAMPT P43490 1/20 0.53
JAK2 O60674 1/20 0.48
JAK1 P23458 1/20 0.48
TYK2 P29597 1/20 0.48
JAK3 P52333 1/20 0.48
GPR119 Q8TDV5 8/20 0.47
KDM4E B2RXH2 1/20 0.46
MAPT P10636 1/20 0.46
THRB P10828 1/20 0.46
PTPN2 P17706 1/20 0.46
PTPN1 P18031 1/20 0.46
PTPN6 P29350 1/20 0.46
HPGDS O60760 1/20 0.46
POLB P06746 1/20 0.45
IGF1R P08069 1/20 0.45

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
SCHEMBL27702405 0.93 DDB1 (0.61) DDB1CRBNWNT3ANAMPTJAK2
SCHEMBL22324899 0.88 DDB1 (0.67) DDB1CRBNWNT3ANAMPTJAK2
SCHEMBL25093627 0.84 DDB1 (0.58) DDB1CRBNWNT3ANAMPTGPR119
SCHEMBL29497122 0.83 DDB1 (0.60) DDB1CRBNWNT3ANAMPTGPR119
SCHEMBL611718 0.83 DDB1 (0.60) DDB1CRBNWNT3ANAMPTGPR119
SCHEMBL666124 0.83 DDB1 (0.60) DDB1CRBNWNT3ANAMPTGPR119
SCHEMBL31737074 0.83 DDB1 (0.60) DDB1CRBNWNT3ANAMPTGPR119
SCHEMBL25931442 0.83 DDB1 (0.60) DDB1CRBNWNT3ANAMPTGPR119
SCHEMBL22895872 0.83 DDB1 (0.63) DDB1CRBNWNT3ANAMPTJAK1
SCHEMBL28550157 0.83 DDB1 (0.63) DDB1CRBNWNT3ANAMPTJAK1

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
CN-107759563-B Preparation method of 4- (6-substituted aminopyridine-3-yl) piperidine-1-tert-butyl formate 上海再启生物技术有限公司 2020-06-02 CN claimed
CN-107759563-B Preparation method of 4- (6-substituted aminopyridine-3-yl) piperidine-1-tert-butyl formate 上海再启生物技术有限公司 2020-06-02 CN disclosed