SCHEMBL28159336

SCHEMBL28159336

CCO[Si](OCC)(OCC)N1[CH]Sc2ccccc21

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ BCHE P06276 6/20 0.37
▸ MAOA P21397 1/20 0.32
▸ MAPT P10636 3/20 0.32
▸ HTT P42858 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ POLB P06746 2/20 0.30
▸ GAA P10253 1/20 0.30
▸ ATM Q13315 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
SCHEMBL9771541 0.67 MAOA (0.39) BCHEMAOAMAPTHTTNPSR1
SCHEMBL8525463 0.65 PPARG (0.39) BCHEALDH1A1POLB
Hydrogen Sulfide SCHEMBL813627 0.64 PPARG (0.38) BCHEALDH1A1POLB
SCHEMBL2301947 0.64 MAOA (0.48) BCHEMAOAMAPTNPSR1ALDH1A1
SCHEMBL5707864 0.62 MAOA (0.38) BCHEMAOAMAPTHTTALDH1A1
SCHEMBL18660392 0.60 PDF (0.42) BCHEMAOAMAPTHTTALDH1A1
SCHEMBL2683324 0.60 BCHE (0.39) BCHEMAOA
SCHEMBL7611171 0.60 BCHE (0.56) BCHEMAOAMAPTHTTNPSR1
SCHEMBL1143802 0.60 MAOA (0.39) BCHEMAOAMAPTALDH1A1
SCHEMBL31075011 0.59 KDM1A (0.55) MAPTNPSR1ALDH1A1

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-103987774-B Rubber composition and pneumatic tire 住友橡胶工业株式会社 2018-10-26 — — CN disclosed
CN-106916351-B Rubber composition and pneumatic tire 住友橡胶工业株式会社 2018-05-22 — — CN disclosed
CN-106916351-A Rubber composition and pneumatic tire 住友橡胶工业株式会社 2017-07-04 — — CN disclosed
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