SCHEMBL9616033

SCHEMBL9616033

CCCCCCCCC(C)[Na]

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.50
TSHR P16473 1/20 0.47
THRB P10828 1/20 0.47
SPHK1 Q9NYA1 1/20 0.46
LMNA P02545 1/20 0.46
DNM1 Q05193 2/20 0.46
GPR84 Q9NQS5 6/20 0.43
ADH1B P00325 1/20 0.43
ADH1C P00326 1/20 0.43
ADH1A P07327 1/20 0.43
ADH4 P08319 1/20 0.43
ADH7 P40394 1/20 0.43
ACE2 Q9BYF1 1/20 0.41
FDPS P14324 1/20 0.41

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
SCHEMBL28208081 1.00 OPRM1 (0.50) OPRM1TSHRTHRBSPHK1LMNA
SCHEMBL30557905 1.00 OPRM1 (0.50) OPRM1TSHRTHRBSPHK1LMNA
SCHEMBL28252507 1.00
SCHEMBL29456006 1.00 OPRM1 (0.50) OPRM1TSHRTHRBSPHK1LMNA
SCHEMBL8084493 1.00 OPRM1 (0.50) OPRM1TSHRTHRBSPHK1LMNA
SCHEMBL27824127 1.00 OPRM1 (0.50) OPRM1TSHRTHRBSPHK1LMNA
SCHEMBL30557906 1.00 OPRM1 (0.50) OPRM1TSHRTHRBSPHK1LMNA
SCHEMBL28778956 1.00 OPRM1 (0.50) OPRM1TSHRTHRBSPHK1LMNA
SCHEMBL6889786 0.88
Sulfuric Acid SCHEMBL27725363 0.86 TP53 (0.61) SPHK1LMNAGPR84ACE2FDPS

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
JP-4290888-A None JP disclosed
JP-H04290888-A PHOSPHATE ESTER AND PHOSPHATE ESTER-CONTAINING COMPOSITION UNILEVER NV 1992-10-15 JP disclosed