SCHEMBL19769337

SCHEMBL19769337

CCC1CCC(CNCC2CCC(CN)CC2)CC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SAT1 P21673 1/20 0.42
CYP2D6 P10635 2/20 0.41
PLG P00747 1/20 0.40
PLAT P00750 1/20 0.40
LMNA P02545 1/20 0.40
NCF1 P14598 1/20 0.38
TDP1 Q9NUW8 1/20 0.37
GNAI3 P08754 2/20 0.33
GNAO1 P09471 2/20 0.33
GNAI1 P63096 2/20 0.33
TPSAB1 Q15661 1/20 0.33
TPSD1 Q9BZJ3 1/20 0.33
TPSG1 Q9NRR2 1/20 0.33
MEN1 O00255 1/20 0.32
TP53 P04637 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
RECQL P46063 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL19780933 0.88 CYP2D6 (0.48) SAT1CYP2D6PLGPLATLMNA
SCHEMBL178372 0.85 NCF1 (0.48) CYP2D6PLGPLATLMNANCF1
SCHEMBL12820123 0.85 NCF1 (0.48) CYP2D6PLGPLATLMNANCF1
SCHEMBL12441541 0.85 NCF1 (0.48) CYP2D6PLGPLATLMNANCF1
SCHEMBL17592440 0.84 SAT1 (0.54) SAT1CYP2D6PLGPLATLMNA
SCHEMBL17592442 0.84 SAT1 (0.54) SAT1CYP2D6PLGPLATLMNA
SCHEMBL19933010 0.81 CYP2D6 (0.53) SAT1CYP2D6PLGPLATLMNA
SCHEMBL18232481 0.78 CYP2D6 (0.39) SAT1CYP2D6PLGPLATLMNA
SCHEMBL12161419 0.78 SAT1 (0.58) SAT1CYP2D6TDP1GNAI3GNAO1
SCHEMBL23139644 0.78 NCF1 (0.42) CYP2D6PLGPLATLMNANCF1

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
US-20180016394-A1 Polyamide Resin, Polyamide Resin Composition Containing Same, Preparation Method Therefor, and Molded Product Including Same LOTTE ADVANCED MATERIALS CO., LTD. (KR) 2018-01-18 US disclosed