SCHEMBL31037491

SCHEMBL31037491

C#Cc1ccc(C2CCN(C(=O)OC(C)(C)C)CC2)cc1.CC(C)(C)OC(=O)N1CCC(c2ccc(C#C[Si](C)(C)C)cc2)CC1

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 1/20 0.48
DDB1 Q16531 1/20 0.44
CRBN Q96SW2 1/20 0.44
GPR119 Q8TDV5 5/20 0.44
JAK2 O60674 1/20 0.44
JAK3 P52333 1/20 0.44
PTK2 Q05397 1/20 0.44
THRB P10828 2/20 0.42
MAPT P10636 2/20 0.42
KDM4E B2RXH2 1/20 0.42
PTPN2 P17706 1/20 0.42
PTPN1 P18031 1/20 0.42
PTPN6 P29350 1/20 0.42
RET P07949 1/20 0.42
STS P08842 1/20 0.41
GAA P10253 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
RECQL P46063 1/20 0.40
PDE4B Q07343 1/20 0.40

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
SCHEMBL12378796 0.94 NAMPT (0.53) NAMPTDDB1CRBNGPR119JAK2
SCHEMBL12378795 0.90 NAMPT (0.57) NAMPTDDB1CRBNGPR119JAK2
SCHEMBL31274808 0.89 NAMPT (0.48) NAMPTDDB1CRBNGPR119JAK2
SCHEMBL7499165 0.80 NAMPT (0.54) NAMPTDDB1CRBNGPR119JAK2
SCHEMBL28415386 0.78 FAAH (0.47) GPR119MAPTKDM4ESTS
SCHEMBL6132557 0.78 GPR119 (0.64) NAMPTDDB1CRBNGPR119JAK2
SCHEMBL23119768 0.78 RORC (0.47) NAMPTGPR119KDM4EPTPN2PTPN1
SCHEMBL15554611 0.78 SCD5 (0.41) SMN1; SMN2
SCHEMBL17275228 0.77 FAAH (0.48) GPR119THRBKDM4ESTSGAA
SCHEMBL12416079 0.77 NAMPT (0.58) NAMPTDDB1CRBNGPR119THRB

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
WO-2024246764-A1 NOVEL BENZAMIDE DERIVATIVE COMPOUND AND PHARMACEUTICAL COMPOSITION COMPRISING SAME 삼진제약주식회사 2024-12-05 WO disclosed
WO-2024166024-A1 NEW COMPOUND AND PHARMACEUTICAL COMPOSITION COMPRISING SAME 삼진제약주식회사 2024-08-15 WO disclosed