SCHEMBL9858535

SCHEMBL9858535

O=C(CCS)OCCCO.O=C(CCS)OS

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.34
DNM1 Q05193 1/20 0.33
ADRA2A P08913 1/20 0.32
ADRA1A P35348 1/20 0.32
MGLL Q99685 1/20 0.32
HTR2C P28335 1/20 0.32
MAPT P10636 1/20 0.31
BLM P54132 1/20 0.31
FNTA P49354 1/20 0.31
FNTB P49356 1/20 0.31
NAAA Q02083 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
SCHEMBL5489378 0.92 DGKA (0.39) DGKADNM1ADRA2AADRA1AMGLL
SCHEMBL28071538 0.86 ACHE (0.38) DGKADNM1ADRA2AADRA1AMGLL
Ethylene Glycol SCHEMBL17106634 0.84 DGKA (0.39) DGKADNM1ADRA2AADRA1AMGLL
SCHEMBL97503 0.81 NAAA (0.43) DGKADNM1ADRA2AADRA1AHTR2C
SCHEMBL99058 0.81 DGKA (0.43) DGKADNM1ADRA2AADRA1AHTR2C
SCHEMBL718982 0.79
SCHEMBL6603463 0.79 NAAA (0.46) DGKADNM1ADRA2AADRA1AHTR2C
SCHEMBL6599291 0.79 NAAA (0.46) DGKADNM1ADRA2AADRA1AHTR2C
SCHEMBL98936 0.79 NAAA (0.46) DGKADNM1ADRA2AADRA1AHTR2C
SCHEMBL98181 0.79 NAAA (0.46) DGKADNM1ADRA2AADRA1AHTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0422836-A2 Resin for urethane lenses, lenses comprising the resin, and a process for preparation of the resin and the lenses MITSUI TOATSU CHEMICALS, Inc. (JP) 1991-04-17 EP disclosed