SCHEMBL30165149

SCHEMBL30165149

C[Si](C)(C)CCOCn1cnccc1=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
DGAT1 O75907 3/20 0.36
NPC1 O15118 1/20 0.34
EGFR P00533 1/20 0.34
IGF1R P08069 1/20 0.34
SRC P12931 1/20 0.34
FLT4 P35916 1/20 0.34
KDR P35968 1/20 0.34
FLT3 P36888 1/20 0.34
EPHB4 P54760 1/20 0.34
TEK Q02763 1/20 0.34
BRD4 O60885 1/20 0.34
CREBBP Q92793 1/20 0.34
MAPT P10636 1/20 0.34
DUT P33316 1/20 0.33
EIF4EBP1 Q13541 1/20 0.32
MAPK14 Q16539 1/20 0.31
USP7 Q93009 1/20 0.31
KLKB1 P03952 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
SCHEMBL200911 0.78 NPC1 (0.41) SMN1; SMN2DGAT1NPC1EGFRIGF1R
SCHEMBL30719394 0.76 DGAT1 (0.36) DGAT1NPC1EGFRIGF1RSRC
SCHEMBL22075678 0.75 CYP11B1 (0.43) ALDH1A1SMN1; SMN2DGAT1MAPTMAPK14
SCHEMBL16679708 0.74 DGAT1 (0.43) DGAT1NPC1EGFRIGF1RSRC
SCHEMBL28966690 0.73 DGAT1 (0.35) DGAT1NPC1EGFRIGF1RSRC
SCHEMBL30846745 0.73 DUT (0.35) DGAT1NPC1EGFRIGF1RSRC
SCHEMBL1858220 0.72 DGAT1 (0.40) DGAT1
SCHEMBL1978323 0.72 TYR (0.42) DGAT1NPC1EGFRIGF1RSRC
SCHEMBL24766780 0.71 DGAT1 (0.37) DGAT1
SCHEMBL1396124 0.71 DGAT1 (0.37) DGAT1NPC1BRD4CREBBP

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-115745971-B PARP7 inhibitor and application thereof 北京华森英诺生物科技有限公司 2024-07-30 CN disclosed
CN-115745971-A PARP7 inhibitor and application thereof 重庆华森制药股份有限公司 2023-03-07 CN disclosed