SCHEMBL28849178

SCHEMBL28849178

CC(C)(C)[Si](C)(C)OOP(=O)(O)Oc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.47
▸ SRC P12931 1/20 0.46
▸ POLB P06746 1/20 0.40
▸ ANPEP P15144 1/20 0.37
▸ LAP3 P28838 1/20 0.37
▸ L3MBTL1 Q9Y468 3/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ BTN3A1 O00481 3/20 0.36
▸ ATM Q13315 1/20 0.36
▸ CES2 O00748 1/20 0.36
▸ CES1 P23141 1/20 0.36
▸ CYP2C9 P11712 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35

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
SCHEMBL28849177 0.84 ALDH1A1 (0.49) ALDH1A1SRCPOLBANPEPLAP3
SCHEMBL1128545 0.74 SRC (0.57) ALDH1A1SRCPOLBANPEPLAP3
SCHEMBL37038 0.73 SRC (0.73) ALDH1A1SRCPOLBANPEPLAP3
SCHEMBL27676341 0.73 SRC (0.73) ALDH1A1SRCPOLBANPEPLAP3
Benzene SCHEMBL11142811 0.73 SRC (0.73) ALDH1A1SRCPOLBANPEPLAP3
SCHEMBL27715051 0.73 SRC (0.55) ALDH1A1SRCPOLBANPEPLAP3
SCHEMBL525387 0.73 SRC (0.55) ALDH1A1SRCPOLBANPEPLAP3
SCHEMBL28441444 0.72 SRC (0.59) ALDH1A1SRCPOLBANPEPLAP3
O-Xylene SCHEMBL8467422 0.72 SRC (0.59) ALDH1A1SRCPOLBANPEPLAP3
Methylamine SCHEMBL11592407 0.72 SRC (0.64) ALDH1A1SRCPOLBANPEPLAP3

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
CN-115093657-A Wear-resistant PVC material and application thereof 广东亮丰达实业有限公司 2022-09-23 — — CN claimed
CN-115093657-B Wear-resistant PVC material and application thereof 广东亮丰达实业有限公司 2024-04-30 — — CN disclosed
CN-115093657-A Wear-resistant PVC material and application thereof 广东亮丰达实业有限公司 2022-09-23 — — CN disclosed
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