SCHEMBL23071129

SCHEMBL23071129

COCC1(C#N)CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
CTSK P43235 1/20 0.44
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
ALDH1A1 P00352 1/20 0.42
MAPT P10636 1/20 0.42
JAK2 O60674 5/20 0.40
JAK1 P23458 5/20 0.40
HPGD P15428 1/20 0.39
EPHX2 P34913 1/20 0.39
GPR119 Q8TDV5 2/20 0.38
NAMPT P43490 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
SCHEMBL29222475 0.89 USP2 (0.41) USP2SMN1; SMN2CTSKMEN1KMT2A
SCHEMBL17830842 0.88 USP2 (0.45) USP2SMN1; SMN2CTSKMEN1KMT2A
SCHEMBL1476907 0.88 USP2 (0.45) USP2SMN1; SMN2CTSKMEN1KMT2A
SCHEMBL10529377 0.87 USP2 (0.44) USP2SMN1; SMN2CTSKMEN1KMT2A
SCHEMBL17176669 0.87 JAK2 (0.44) USP2SMN1; SMN2CTSKMEN1KMT2A
SCHEMBL23283111 0.87 USP2 (0.44) USP2SMN1; SMN2CTSKMEN1KMT2A
SCHEMBL20571615 0.87 USP2 (0.44) USP2SMN1; SMN2CTSKMEN1KMT2A
SCHEMBL25305211 0.86 CTSK (0.42) USP2SMN1; SMN2CTSKMEN1KMT2A
SCHEMBL16914502 0.86 USP2 (0.41) USP2SMN1; SMN2CTSKMEN1KMT2A
SCHEMBL2798365 0.85 USP2 (0.43) USP2SMN1; SMN2CTSKMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114127053-B Substituted pyrazine compound, preparation method and application thereof 四川科伦博泰生物医药股份有限公司 2023-06-13 CN disclosed
CN-114127053-A Substituted pyrazine compound, preparation method and application thereof 四川科伦博泰生物医药股份有限公司 2022-03-01 CN disclosed
WO-2021043077-A1 SUBSTITUTED PYRAZINE COMPOUND AND PREPARATION METHOD THEREFOR AND USE THEREOF 四川科伦博泰生物医药股份有限公司 2021-03-11 WO disclosed