SCHEMBL28147368

SCHEMBL28147368

N#Cc1cccc2c(OC(=O)C(O)C(O)C(=O)Oc3c[nH]c4c(C#N)cccc34)c[nH]c12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DYRK1A Q13627 5/20 0.40
▸ GSK3B P49841 2/20 0.38
▸ NFATC1 O95644 1/20 0.38
▸ SLC6A4 P31645 2/20 0.37
▸ NR3C1 P04150 1/20 0.36
▸ PGR P06401 1/20 0.36
▸ NR3C2 P08235 1/20 0.36
▸ SLC22A6 Q4U2R8 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ IMPDH2 P12268 1/20 0.33
▸ IMPDH1 P20839 1/20 0.33
▸ CLEC4M Q9H2X3 1/20 0.33
▸ BRPF1 P55201 1/20 0.33
▸ CA1 P00915 1/20 0.33
▸ CA2 P00918 1/20 0.33
▸ MCL1 Q07820 2/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL27939095 0.83 SLC22A6 (0.54) DYRK1AGSK3BNFATC1SLC6A4NR3C1
Quinoline SCHEMBL27875441 0.83 DYRK1A (0.37) DYRK1AGSK3BNFATC1KDM4EALDH1A1
SCHEMBL8591739 0.77 CLEC4M (0.42) SLC22A6KDM4EALDH1A1HPGDCLEC4M
SCHEMBL21806575 0.72 SLC22A6 (0.66) SLC22A6KDM4EALDH1A1SMN1; SMN2MEN1
SCHEMBL24328918 0.72 SMN1; SMN2 (0.57) DYRK1AGSK3BNFATC1SLC6A4NR3C1
SCHEMBL19117524 0.70 DYRK1A (0.51) DYRK1AGSK3BNFATC1SLC6A4NR3C1
SCHEMBL9936453 0.69 NR4A2 (0.65) DYRK1AKDM4EALDH1A1HPGDBRPF1
SCHEMBL24328259 0.69 NR3C1 (0.47) DYRK1ASLC6A4NR3C1PGRNR3C2
SCHEMBL2963561 0.69 CLEC4M (0.73) KDM4EALDH1A1HPGDCLEC4MMEN1
SCHEMBL1420209 0.69 SMN1; SMN2 (0.52) NR3C1PGRNR3C2ALDH1A1MAPK1

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-106995399-A A kind of method for preparing Silodosin 北京天泰恒华医药技术有限公司 2017-08-01 — — CN disclosed
CN-106995399-A A kind of method for preparing Silodosin 北京天泰恒华医药技术有限公司 2017-08-01 — — CN disclosed
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