SCHEMBL8825947

SCHEMBL8825947

C[C@H](/C=C/Sc1ccccc1)O[Si](C)(C)C(C)(C)C

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PLIN1 O60240 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
HPGD P15428 1/20 0.32
HTT P42858 1/20 0.32
PLIN5 Q00G26 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
ABHD5 Q8WTS1 1/20 0.32

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
SCHEMBL8825842 1.00 PLIN1 (0.32) PLIN1ALDH1A1LMNAMAPTHPGD
SCHEMBL9118305 1.00 PLIN1 (0.32) PLIN1ALDH1A1LMNAMAPTHPGD
SCHEMBL8826057 0.87 MEN1 (0.33) ALDH1A1LMNAMAPTNPSR1
SCHEMBL8826055 0.87 MEN1 (0.33) ALDH1A1LMNAMAPTNPSR1
SCHEMBL10500652 0.85 ALDH1A1 (0.30) ALDH1A1LMNAMAPTNPSR1
SCHEMBL8825721 0.85 ALDH1A1 (0.30) ALDH1A1LMNAMAPTNPSR1
SCHEMBL10500661 0.85 ALDH1A1 (0.30) ALDH1A1LMNAMAPTNPSR1
SCHEMBL8825724 0.85 ALDH1A1 (0.30) ALDH1A1LMNAMAPTNPSR1
SCHEMBL10500525 0.84 CYP1A1 (0.36) ALDH1A1
SCHEMBL8826045 0.84 CYP1A1 (0.36) ALDH1A1

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-5591881-A DEGRADING TRIALKYLSILYL PROTECTED-THREONINE WITH NINHYDRIN; PERFORMING HONOR-WORDSWORTH-EMONS REACTION CHOONGWAE PHARMACEUTICAL CO., LTD. (KR) 1997-01-07 US claimed
US-5591881-A DEGRADING TRIALKYLSILYL PROTECTED-THREONINE WITH NINHYDRIN; PERFORMING HONOR-WORDSWORTH-EMONS REACTION CHOONGWAE PHARMACEUTICAL CO., LTD. (KR) 1997-01-07 US disclosed