SCHEMBL30833164

SCHEMBL30833164

CC(C)(C)OC(=O)N1CCC2(CC1)COC[C@H]2N[S@+]([O-])C(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
PTPN11 Q06124 3/20 0.39
EPHX2 P34913 1/20 0.39
GPR119 Q8TDV5 3/20 0.38
RECQL P46063 1/20 0.38
NAMPT P43490 5/20 0.35
CCR2 P41597 1/20 0.35
EPHX1 P07099 1/20 0.35

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
SCHEMBL18392380 1.00 USP2 (0.41) USP2SMN1; SMN2PTPN11EPHX2GPR119
SCHEMBL20337474 1.00 USP2 (0.41) USP2SMN1; SMN2PTPN11EPHX2GPR119
SCHEMBL30197470 1.00 USP2 (0.41) USP2SMN1; SMN2PTPN11EPHX2GPR119
SCHEMBL18328440 1.00 USP2 (0.41) USP2SMN1; SMN2PTPN11EPHX2GPR119
SCHEMBL30197520 0.87 USP2 (0.39) USP2SMN1; SMN2EPHX2GPR119RECQL
SCHEMBL16914196 0.86 PTPN11 (0.41) PTPN11
SCHEMBL21631388 0.86 PTPN11 (0.41) PTPN11
SCHEMBL22799125 0.86 PTPN11 (0.41) PTPN11
SCHEMBL22016006 0.86 USP2 (0.39) USP2SMN1; SMN2PTPN11EPHX2GPR119
SCHEMBL31336383 0.83 EPHX1 (0.40) USP2SMN1; SMN2EPHX2GPR119RECQL

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-112625028-B Compounds and compositions for inhibiting SHP2 activity 诺华股份有限公司 2024-10-29 CN disclosed
CN-115448923-B Pyrimidine-fused ring compound, preparation method and application thereof 上海青煜医药科技有限公司 2024-03-22 CN disclosed