SCHEMBL28040770

SCHEMBL28040770

CCc1cc(CC)cc([Si]([C]2C(C)=Cc3ccccc32)(c2cc(CC)cc(CC)c2)c2cc(CC)cc(CC)c2)c1

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTAFR P25105 1/20 0.33
NPC1 O15118 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
MAPK1 P28482 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
RPS6KA2 Q15349 1/20 0.31
TP53 P04637 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
SCHEMBL28040821 0.84 GPR3 (0.39) L3MBTL1
SCHEMBL28040845 0.79 LMNA (0.32) ALDH1A1LMNAMAPTMAPK1SMN1; SMN2
SCHEMBL28040843 0.79 MAPT (0.39) NPC1ALDH1A1LMNAMAPTMAPK1
SCHEMBL28040823 0.78 LOXL2 (0.35) ALDH1A1SMN1; SMN2
SCHEMBL28040359 0.76 PTAFR (0.34) PTAFRNPC1ALDH1A1RAB9AL3MBTL1
SCHEMBL28823631 0.76 CDC25A (0.35)
SCHEMBL28040416 0.75 HSD11B1 (0.40) ALDH1A1SMN1; SMN2
SCHEMBL28040608 0.72 LMNA (0.34) NPC1ALDH1A1LMNAMAPTMAPK1
SCHEMBL28040418 0.71 CDC25A (0.33) ALDH1A1LMNAMAPTSMN1; SMN2TP53
SCHEMBL28040414 0.67 ESR1 (0.38) PTAFRLMNA

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-102666561-B Transition metal complex, the cyclopentadiene compound of catalyst for trimerization and replacement SUMITOMO CHEMICAL CO.,LTD. (JP) 2015-11-25 CN disclosed