SCHEMBL31336207

SCHEMBL31336207

CC(C)[Si](Oc1cccc2oc3c4ccccc4ccc3c12)(C(C)C)C(C)C

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ABCG2 Q9UNQ0 5/20 0.37
▸ ABCC1 P33527 4/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ IKBKB O14920 1/20 0.36
▸ KDM4E B2RXH2 3/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ MAOA P21397 2/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ ABCB1 P08183 2/20 0.36
▸ L3MBTL1 Q9Y468 2/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ HPGD P15428 2/20 0.35
▸ ALOX15 P16050 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ CYP1A1 P04798 5/20 0.34
▸ CYP1B1 Q16678 5/20 0.34
▸ CYP1A2 P05177 3/20 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
SCHEMBL22534456 0.82 ABCG2 (0.36) ABCG2ABCC1KMT2AIKBKBKDM4E
SCHEMBL3830596 0.82 MAOA (0.46) KMT2AKDM4EALDH1A1MAOANPC1
SCHEMBL24481481 0.80 MAOA (0.53) ABCG2ABCC1KDM4EALDH1A1MAOA
SCHEMBL31336167 0.80 ABCG2 (0.39) ABCG2ABCC1KMT2AIKBKBKDM4E
SCHEMBL31533293 0.78 KMT2A (0.37) KMT2AKDM4EALDH1A1MAOANPC1
SCHEMBL24501827 0.75 L3MBTL1 (0.44) ABCG2ABCC1KMT2AIKBKBKDM4E
SCHEMBL31373204 0.74 L3MBTL1 (0.38) ABCG2ABCC1KMT2AIKBKBKDM4E
SCHEMBL25858219 0.74 TDP1 (0.38) ABCG2ABCC1KMT2AIKBKBKDM4E
SCHEMBL13935799 0.73 L3MBTL1 (0.47) ABCG2ABCC1KMT2AIKBKBKDM4E
SCHEMBL19784562 0.72 L3MBTL1 (0.44) ABCG2ABCC1KMT2AIKBKBKDM4E

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-113631543-B Organic electroluminescent element and electronic device using the same 出光兴产株式会社 2025-01-17 — — CN disclosed
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