SCHEMBL7956247

SCHEMBL7956247

BC(C)CCCCCCCC

nearest known ligand 0.50

Predicted protein targets (top 19)

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
LCK P06239 1/20 0.44
PPARD Q03181 1/20 0.44
ZDHHC20 Q5W0Z9 1/20 0.44
ZDHHC2 Q9UIJ5 1/20 0.44
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
GPR84 Q9NQS5 3/20 0.41
FDPS P14324 3/20 0.41
FFAR1 O14842 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
SCHEMBL13564506 1.00 OPRM1 (0.50) OPRM1TSHRTHRBSPHK1LMNA
SCHEMBL12452029 1.00 OPRM1 (0.50) OPRM1TSHRTHRBSPHK1LMNA
SCHEMBL17002470 1.00 OPRM1 (0.50) OPRM1TSHRTHRBSPHK1LMNA
SCHEMBL14072212 1.00 OPRM1 (0.50) OPRM1TSHRTHRBSPHK1LMNA
SCHEMBL13985798 1.00 OPRM1 (0.50) OPRM1TSHRTHRBSPHK1LMNA
SCHEMBL14639849 1.00 OPRM1 (0.50) OPRM1TSHRTHRBSPHK1LMNA
SCHEMBL17002463 1.00 OPRM1 (0.50) OPRM1TSHRTHRBSPHK1LMNA
SCHEMBL12164023 0.97
SCHEMBL18104779 0.92 ACE2 (0.52) OPRM1TSHRTHRBSPHK1LMNA
SCHEMBL9604628 0.88

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
WO-2009137462-A2 METHODS FOR TREATING COGNITIVE DISORDERS USING INHIBITORS OF HISTONE DEACETYLASE ENVIVO PHARMACEUTICALS, INC. (US) 2009-11-12 WO disclosed