SCHEMBL28240381

SCHEMBL28240381

O=C(O)CCP(=O)(O)c1ccccc1.[Nd]

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CFTR P13569 1/20 0.69
ALDH1A1 P00352 4/20 0.55
NPSR1 Q6W5P4 2/20 0.53
USP2 O75604 1/20 0.48
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
CA2 P00918 1/20 0.46
CA4 P22748 1/20 0.46
CA5A P35218 1/20 0.46
GGH Q92820 1/20 0.46
GAA P10253 2/20 0.44
PTPN2 P17706 1/20 0.44
PTPN1 P18031 1/20 0.44
PTPN4 P29074 1/20 0.44
PTPN9 P43378 1/20 0.44
PTPN11 Q06124 1/20 0.44
CYP1A2 P05177 1/20 0.42
CYP2D6 P10635 1/20 0.42
TSHR P16473 1/20 0.42
CYP2C19 P33261 1/20 0.42

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
SCHEMBL19773247 0.98 CFTR (0.72) CFTRALDH1A1NPSR1USP2MEN1
SCHEMBL65139 0.98 CFTR (0.72) CFTRALDH1A1NPSR1USP2MEN1
SCHEMBL28370872 0.96 CFTR (0.69) CFTRALDH1A1NPSR1USP2MEN1
SCHEMBL28863808 0.96 CFTR (0.69) CFTRALDH1A1NPSR1USP2MEN1
SCHEMBL28370870 0.96 CFTR (0.69) CFTRALDH1A1NPSR1USP2MEN1
SCHEMBL38665525 0.96 CFTR (0.69) CFTRALDH1A1NPSR1USP2MEN1
SCHEMBL28377136 0.96 CFTR (0.69) CFTRALDH1A1NPSR1USP2MEN1
SCHEMBL28371245 0.96 CFTR (0.69) CFTRALDH1A1NPSR1USP2MEN1
SCHEMBL28271931 0.96 CFTR (0.69) CFTRALDH1A1NPSR1USP2MEN1
SCHEMBL28202078 0.96 CFTR (0.69) CFTRALDH1A1NPSR1USP2MEN1

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-108517120-A A kind of ageing-resistant silastic material and preparation method thereof 天长市荣盛有机硅科技有限公司 2018-09-11 CN claimed
CN-108517120-A A kind of ageing-resistant silastic material and preparation method thereof 天长市荣盛有机硅科技有限公司 2018-09-11 CN disclosed