SCHEMBL24554516

SCHEMBL24554516

C[Si](C)(C)CCOCn1cc(C=O)c2ccc3ccccc3c21

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.37
TDP1 Q9NUW8 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
ALDH1A1 P00352 4/20 0.36
NPC1 O15118 3/20 0.36
MAPT P10636 2/20 0.36
RAB9A P51151 2/20 0.36
HPGD P15428 2/20 0.36
LMNA P02545 1/20 0.36
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
EGFR P00533 1/20 0.35
IGF1R P08069 1/20 0.35
SRC P12931 1/20 0.35
FLT4 P35916 1/20 0.35
KDR P35968 1/20 0.35
FLT3 P36888 1/20 0.35
EPHB4 P54760 1/20 0.35
TEK Q02763 1/20 0.35
MEN1 O00255 1/20 0.34

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
SCHEMBL23538115 0.82 POLB (0.52) POLBTDP1L3MBTL1ALDH1A1NPC1
SCHEMBL15546774 0.76 POLB (0.39) POLBTDP1L3MBTL1ALDH1A1NPC1
SCHEMBL31521561 0.76 DGAT1 (0.36) POLBL3MBTL1NPC1LMNAHTT
SCHEMBL23551437 0.72 ALDH1A1 (0.54) POLBTDP1L3MBTL1ALDH1A1NPC1
SCHEMBL1049931 0.71 KRAS (0.41) POLBTDP1L3MBTL1ALDH1A1NPC1
SCHEMBL13057796 0.71 EGFR (0.39) POLBTDP1L3MBTL1ALDH1A1NPC1
SCHEMBL23855061 0.70 NPC1 (0.40) POLBALDH1A1NPC1MAPTRAB9A
SCHEMBL23855046 0.70 ALDH1A1 (0.45) POLBALDH1A1NPC1MAPTRAB9A
SCHEMBL23551502 0.70 CNR2 (0.40) ALDH1A1NPC1MAPTRAB9AHPGD
SCHEMBL17100403 0.68 POLB (0.38) POLBTDP1L3MBTL1ALDH1A1NPC1

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
WO-2022133480-A1 ARYL HYDROCARBON RECEPTOR (AHR) AGONISTS AND USES THEREOF Ikena Oncology, Inc. (US) 2022-06-23 WO disclosed
WO-2022133480-A1 ARYL HYDROCARBON RECEPTOR (AHR) AGONISTS AND USES THEREOF Ikena Oncology, Inc. (US) 2022-06-23 WO disclosed