SCHEMBL28477273

SCHEMBL28477273

CCCCCCCCCCC(C)C(C)(C)S

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.42
SPHK1 Q9NYA1 1/20 0.40
LMNA P02545 1/20 0.39
DNM1 Q05193 2/20 0.39
TSHR P16473 1/20 0.38
THRB P10828 1/20 0.38
ADH1B P00325 1/20 0.38
ADH1C P00326 1/20 0.38
ADH1A P07327 1/20 0.38
ADH4 P08319 1/20 0.38
ADH7 P40394 1/20 0.38
CA2 P00918 1/20 0.38
ACE2 Q9BYF1 1/20 0.36
GPR84 Q9NQS5 3/20 0.35
FDPS P14324 3/20 0.35
FFAR1 O14842 1/20 0.35

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
Bromide SCHEMBL6131225 0.98 OPRM1 (0.41) OPRM1SPHK1LMNADNM1TSHR
SCHEMBL19577206 0.82 OPRM1 (0.39) OPRM1SPHK1LMNADNM1TSHR
SCHEMBL11286280 0.82 CA2 (0.44) OPRM1SPHK1LMNACA2ACE2
SCHEMBL8066854 0.80 OPRM1 (0.46) OPRM1SPHK1LMNADNM1TSHR
SCHEMBL6060338 0.80 OPRM1 (0.46) OPRM1SPHK1LMNADNM1TSHR
SCHEMBL23803921 0.80 OPRM1 (0.46) OPRM1SPHK1LMNADNM1TSHR
SCHEMBL6700324 0.80 OPRM1 (0.46) OPRM1SPHK1LMNADNM1TSHR
SCHEMBL615029 0.80 OPRM1 (0.46) OPRM1SPHK1LMNADNM1TSHR
SCHEMBL6408263 0.80 OPRM1 (0.46) OPRM1SPHK1LMNADNM1TSHR
SCHEMBL10587140 0.80 OPRM1 (0.46) OPRM1SPHK1LMNADNM1TSHR

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
CN-108368393-B Surface protective film and optical member 日东电工株式会社 2020-10-16 CN disclosed