SCHEMBL14159308

SCHEMBL14159308

CC(C)CCCCCCC(=O)NCCOCCO

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CNR1 P21554 2/20 0.50
▸ CNR2 P34972 2/20 0.50
▸ HPGD P15428 1/20 0.45
▸ GLP1R P43220 8/20 0.42
▸ MEN1 O00255 2/20 0.41
▸ TSHR P16473 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ CYP2D6 P10635 1/20 0.41
▸ CYP2C9 P11712 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ BLM P54132 1/20 0.41
▸ PMP22 Q01453 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ GAA P10253 1/20 0.41
▸ LMNA P02545 1/20 0.40
▸ PKM P14618 1/20 0.40
▸ PTPN1 P18031 1/20 0.40

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
SCHEMBL23378212 1.00 CNR1 (0.50) CNR1CNR2HPGDGLP1RMEN1
SCHEMBL4270058 0.91 CNR1 (0.44) CNR1CNR2HPGDGLP1RMEN1
SCHEMBL22794220 0.88 GAA (0.49) CNR1CNR2HPGDGLP1RMEN1
SCHEMBL22794221 0.88 GAA (0.49) CNR1CNR2HPGDGLP1RMEN1
SCHEMBL16349899 0.87 ALDH1A1 (0.47) CNR1CNR2HPGDGLP1RMEN1
SCHEMBL4270073 0.87 GAA (0.50) CNR1CNR2HPGDMEN1TSHR
SCHEMBL12013652 0.87 GAA (0.50) CNR1CNR2HPGDMEN1TSHR
SCHEMBL4263001 0.87 GAA (0.50) CNR1CNR2HPGDMEN1TSHR
SCHEMBL12013648 0.87 GAA (0.50) CNR1CNR2HPGDMEN1TSHR
SCHEMBL12013657 0.87 GAA (0.50) CNR1CNR2HPGDMEN1TSHR

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-1468666-B1 Hair shampoo composition KAO CORP (JP) 2008-06-11 — — EP disclosed
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