SCHEMBL30174170

SCHEMBL30174170

Cc1cnc(C(=O)O)c(=O)n1-c1ccc(F)cn1

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MYC P01106 1/20 0.36
NOTUM Q6P988 1/20 0.35
KMT2A Q03164 1/20 0.35
PPARG P37231 1/20 0.34
KDM4E B2RXH2 1/20 0.34
LMNA P02545 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
GRM5 P41594 2/20 0.34
MAPK14 Q16539 3/20 0.33
ALDH1A1 P00352 2/20 0.33
HRH3 Q9Y5N1 1/20 0.33
GRM1 Q13255 2/20 0.33
CNR1 P21554 1/20 0.33
CNR2 P34972 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
SLC27A1 Q6PCB7 2/20 0.32

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
SCHEMBL25227025 1.00 MYC (0.36) MYCNOTUMKMT2APPARGKDM4E
SCHEMBL25529134 0.89 L3MBTL1 (0.38) PPARGKDM4EGRM5MAPK14ALDH1A1
SCHEMBL30174285 0.87 KDM4E (0.36) PPARGKDM4EGRM5MAPK14ALDH1A1
SCHEMBL30063313 0.85 KDM4E (0.40) KMT2AKDM4ESMN1; SMN2GRM5MAPK14
SCHEMBL25533451 0.85 KDM4E (0.40) KMT2AKDM4ESMN1; SMN2GRM5MAPK14
SCHEMBL23147891 0.84 NOTUM (0.49) MYCNOTUMKMT2AKDM4ELMNA
SCHEMBL25528981 0.80 MYC (0.42) MYCNOTUMKMT2AKDM4EALDH1A1
SCHEMBL29812420 0.80 HCAR1 (0.41) MYCNOTUMKDM4ELMNASMN1; SMN2
SCHEMBL23147208 0.80 HCAR1 (0.41) MYCNOTUMKDM4ELMNASMN1; SMN2
SCHEMBL25234474 0.78 L3MBTL1 (0.42) NOTUMPPARGKDM4ELMNASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115605478-A Compounds and methods of use 埃克塞里艾克西斯公司(US) 2023-01-13 CN disclosed