SCHEMBL28201595

SCHEMBL28201595

OCC1=Nc2ncccc2CC1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.36
ALDH1A1 P00352 1/20 0.36
HDAC1 Q13547 3/20 0.33
HDAC6 Q9UBN7 3/20 0.33
RIPK1 Q13546 1/20 0.33
MKNK1 Q9BUB5 2/20 0.33
MKNK2 Q9HBH9 2/20 0.33
KDM4E B2RXH2 1/20 0.32
NPC1 O15118 1/20 0.32
LMNA P02545 1/20 0.32
GAA P10253 1/20 0.32
HTT P42858 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
ADRA2A P08913 1/20 0.31
ADRA2B P18089 1/20 0.31
ADRA2C P18825 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
SCHEMBL28201586 0.78 CYP2A6 (0.36) ALDH1A1HDAC1HDAC6NPC1LMNA
SCHEMBL28201579 0.78 HRH1 (0.35) ALDH1A1KDM4ELMNAADRA2AADRA2B
SCHEMBL28857380 0.73 HRH1 (0.34) HDAC1HDAC6LMNASMN1; SMN2ADRA2A
SCHEMBL4340785 0.73 TSHR (0.32) HDAC1HDAC6LMNA
SCHEMBL28195678 0.72 HDAC1 (0.32) HDAC1HDAC6NPC1RAB9ASMN1; SMN2
SCHEMBL28202178 0.72 HDAC8 (0.32)
SCHEMBL28276888 0.72 CYP11B2 (0.33) KDM4E
SCHEMBL19142282 0.72 CYP11B1 (0.36) L3MBTL1MKNK1MKNK2NPC1RAB9A
SCHEMBL29077469 0.69 NOS3 (0.37) ALDH1A1HDAC1HDAC6MKNK1MKNK2
SCHEMBL28201612 0.68 NPC1 (0.33) ALDH1A1KDM4ENPC1RAB9ASMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105683188-B The ring pyridinyl derivatives of condensed ring two as FGFR4 inhibitor 诺华股份有限公司 2018-02-09 CN claimed
CN-109922804-A COMBINATIONS OF FGFR4 INHIBITORS AND BILE ACID SEQUESTRANTS 诺华股份有限公司 2019-06-21 CN disclosed
CN-105683188-B The ring pyridinyl derivatives of condensed ring two as FGFR4 inhibitor 诺华股份有限公司 2018-02-09 CN disclosed