SCHEMBL17499296

SCHEMBL17499296

CC(=Nc1ccccc1O[SiH](C)C)c1cn(C)nc1C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.38
RAB9A P51151 3/20 0.37
SMN1; SMN2 Q16637 3/20 0.37
NPC1 O15118 2/20 0.37
GAA P10253 5/20 0.36
CYP1A2 P05177 2/20 0.36
CYP2C9 P11712 2/20 0.36
CYP2C19 P33261 1/20 0.36
ALDH1A1 P00352 6/20 0.33
MAPT P10636 2/20 0.33
NAMPT P43490 1/20 0.33
ALPL P05186 1/20 0.32
KDM4E B2RXH2 1/20 0.31
HPGD P15428 1/20 0.31
DUSP3 P51452 1/20 0.31
PTPN5 P54829 1/20 0.31
KMT2A Q03164 1/20 0.31
PTPN11 Q06124 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
EGFR P00533 1/20 0.30

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
SCHEMBL16101313 0.86 NOS3 (0.42) ATMRAB9ASMN1; SMN2NPC1GAA
SCHEMBL17499152 0.85 SMN1; SMN2 (0.35) ATMRAB9ASMN1; SMN2NPC1GAA
SCHEMBL16101305 0.84 RAB9A (0.37) ATMRAB9ASMN1; SMN2NPC1GAA
SCHEMBL28039883 0.84 SMN1; SMN2 (0.35) ATMRAB9ASMN1; SMN2NPC1GAA
SCHEMBL17499214 0.84 ATM (0.39) ATMRAB9ASMN1; SMN2NPC1GAA
SCHEMBL17499130 0.80 NPC1 (0.32) RAB9ASMN1; SMN2NPC1ALDH1A1MAPT
SCHEMBL17499259 0.77 TSHR (0.36) RAB9ASMN1; SMN2NPC1ALDH1A1MAPT
SCHEMBL17499295 0.76 SMN1; SMN2 (0.34) RAB9ASMN1; SMN2ALDH1A1MAPTHPGD
SCHEMBL17499760 0.75 ALDH1A1 (0.30) ALDH1A1MAPTLMNAHSD17B10
SCHEMBL17499692 0.75 TDP1 (0.32) ALDH1A1MAPTLMNAHSD17B10

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
EP-2969593-B1 POLYMERS FUNCTIONALIZED WITH HETEROCYCLIC IMINES BRIDGESTONE CORP (JP) 2020-11-04 EP disclosed
US-9850328-B2 Polymers functionalized with heterocyclic imines BRIDGESTONE CORPORATION (JP) 2017-12-26 US disclosed
US-20160039958-A1 Polymers Functionalized With Heterocyclic Imines BRIDGESTONE CORPORATION (JP) 2016-02-11 US disclosed