SCHEMBL9841198

SCHEMBL9841198

CC(CBr)CCO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SMYD2 Q9NRG4 3/20 0.39
CYP3A4 P08684 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
RIPK1 Q13546 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
SCHEMBL14481194 0.86 SMYD2 (0.39) SMYD2CYP3A4HTTSMN1; SMN2RIPK1
SCHEMBL5275832 0.86 SMYD2 (0.39) SMYD2CYP3A4HTTSMN1; SMN2RIPK1
SCHEMBL5275827 0.86 SMYD2 (0.39) SMYD2CYP3A4HTTSMN1; SMN2RIPK1
SCHEMBL1646323 0.86 SMYD2 (0.35) SMYD2CYP3A4HTTSMN1; SMN2
SCHEMBL4337323 0.86 SMYD2 (0.35) SMYD2CYP3A4HTTSMN1; SMN2
SCHEMBL4337327 0.86 SMYD2 (0.35) SMYD2CYP3A4HTTSMN1; SMN2
SCHEMBL17375324 0.85 SMYD2 (0.41) SMYD2CYP3A4HTTSMN1; SMN2RIPK1
SCHEMBL5027948 0.85 TRPA1 (0.41) SMYD2CYP3A4HTTSMN1; SMN2
SCHEMBL5027949 0.85 TRPA1 (0.41) SMYD2CYP3A4HTTSMN1; SMN2
SCHEMBL31644897 0.85 TRPA1 (0.41) SMYD2CYP3A4HTTSMN1; SMN2

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5077046-A Plant extracts; mannaliam dolichols intermediates KURARAY CO., LTD. (JP) 1991-12-31 US disclosed
US-5012018-A Extending polyisoprene chain using copper catalyst KURARAY CO., LTD. (JP) 1991-04-30 US disclosed
US-4886904-A CONTAINING CIS AND TRANS ISOPRENE UNITS KURARAY CO., LTD. (JP) 1989-12-12 US disclosed
EP-0054753-B1 POLYPRENYL COMPOSITION OR COMPOUNDS AND PROCESS FOR THE PRODUCTION THEREOF KURARAY CO., LTD. (JP) 1985-07-24 EP disclosed
EP-0054753-A1 Polyprenyl composition or compounds and process for the production thereof KURARAY CO., LTD. (JP) 1982-06-30 EP disclosed