SCHEMBL5480187

SCHEMBL5480187

[CH2]CCCC[CH]c1ccc(C)cc1C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AMY1A P0DUB6 1/20 0.36
MAPT P10636 3/20 0.35
LMNA P02545 2/20 0.35
CYP3A4 P08684 1/20 0.33
ADRA2A P08913 1/20 0.33
CYP1A2 P05177 3/20 0.32
TP53 P04637 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
CYP2A6 P11509 2/20 0.32
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 3/20 0.31
RAB9A P51151 2/20 0.31
NCK1 P16333 1/20 0.31
BACE1 P56817 1/20 0.31
PDE5A O76074 1/20 0.31
CYP1A1 P04798 1/20 0.31
CYP1B1 Q16678 1/20 0.31
HTT P42858 1/20 0.30
KMT2A Q03164 1/20 0.30
NPC1 O15118 1/20 0.30

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
SCHEMBL11649550 0.98 AMY1A (0.35) AMY1AMAPTLMNACYP3A4ADRA2A
SCHEMBL11649616 0.87 AMY1A (0.39) AMY1AMAPTLMNACYP3A4ADRA2A
SCHEMBL1611182 0.84 PDE5A (0.40) AMY1AMAPTLMNACYP3A4ADRA2A
SCHEMBL1609536 0.82 PDE5A (0.39) AMY1AMAPTLMNAKDM4EALDH1A1
SCHEMBL1611671 0.82 PDE5A (0.39) AMY1AMAPTLMNAKDM4EALDH1A1
SCHEMBL1610292 0.81 PDE5A (0.44) AMY1AMAPTLMNACYP3A4ADRA2A
SCHEMBL1609490 0.77 AMY1A (0.40) AMY1AMAPTLMNACYP3A4ADRA2A
SCHEMBL1611588 0.74 AMY1A (0.43) AMY1AMAPTLMNACYP3A4ADRA2A
SCHEMBL7168621 0.72 MEP1B (0.33) MAPTTDP1KDM4EALDH1A1PDE5A
SCHEMBL5536028 0.71 PYCR1 (0.39) AMY1AMAPTLMNATP53TDP1

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-20070012569-A1 Cationic electrodeposition coating composition NIPPON PAINT CO., LTD. (JP) 2007-01-18 US disclosed