SCHEMBL3747996

SCHEMBL3747996

CO[Si](OC)(OC)N1c2ccccc2SC1SSSSC1Sc2ccccc2N1[Si](OC)(OC)OC

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ BCHE P06276 1/20 0.30
▸ MAOA P21397 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
Hydrogen Sulfide SCHEMBL7021865 0.71 PPARG (0.39) KDM4ENPC1ALDH1A1HPGDRAB9A
SCHEMBL9720874 0.63 MAOA (0.33) BCHEMAOA
SCHEMBL8469462 0.62 MAOA (0.34) ALDH1A1SMN1; SMN2BCHEMAOA
SCHEMBL30923520 0.61 MAOA (0.41) ALDH1A1RAB9ASMN1; SMN2BCHEMAOA
SCHEMBL4822999 0.61 MAOA (0.41) ALDH1A1RAB9ASMN1; SMN2BCHEMAOA
Iodide SCHEMBL7694591 0.60 MAOA (0.39) ALDH1A1RAB9ASMN1; SMN2BCHEMAOA
SCHEMBL514686 0.58 ALDH1A1 (0.35) ALDH1A1HPGDSMN1; SMN2BCHEMAOA
SCHEMBL303391 0.58 MAOA (0.33) KDM4ENPC1ALDH1A1HPGDRAB9A
SCHEMBL212848 0.58 MAOA (0.33) BCHEMAOA
SCHEMBL11810556 0.58 MAOA (0.37) ALDH1A1SMN1; SMN2BCHEMAOA

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
US-8642705-B2 Conjugated diene polymer, process for its production and rubber compositions containing the same BRIDGESTONE CORPORATION (JP) 2014-02-04 — — US disclosed
US-20100280173-A1 CONJUGATED DIENE POLYMER, PROCESS FOR ITS PRODUCTION AND RUBBER COMPOSITIONS CONTAINING THE SAME BRIDGESTONE CORPORATION (JP) 2010-11-04 — — US disclosed
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