SCHEMBL7765622

SCHEMBL7765622

CCCCCC(CCCCC)C(CN)C(CCCCC)CCCCC

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.46
ALDH1A1 P00352 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
DNM1 Q05193 8/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
TSHR P16473 1/20 0.39
EPHX1 P07099 1/20 0.39
SPHK1 Q9NYA1 1/20 0.38
LMNA P02545 1/20 0.37
TP53 P04637 1/20 0.37

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
SCHEMBL7761886 0.92 ALDH1A1 (0.50) OPRM1ALDH1A1TDP1DNM1MEN1
SCHEMBL23776226 0.81 DNM1 (0.35) OPRM1ALDH1A1TDP1DNM1MEN1
SCHEMBL7765631 0.80 METAP1 (0.37) ALDH1A1TDP1
SCHEMBL7761889 0.77 ALDH1A1 (0.46) OPRM1ALDH1A1TDP1DNM1MEN1
SCHEMBL20254523 0.77 ALDH1A1 (0.46) OPRM1ALDH1A1TDP1DNM1MEN1
SCHEMBL8349912 0.77 ALDH1A1 (0.46) OPRM1ALDH1A1TDP1DNM1MEN1
Hydrochloric Acid SCHEMBL11830045 0.77 DNM1 (0.48) OPRM1ALDH1A1TDP1DNM1MEN1
SCHEMBL23015677 0.77 OPRM1 (0.50) OPRM1ALDH1A1TDP1DNM1MEN1
Hydrochloric Acid SCHEMBL11839222 0.77 DNM1 (0.48) OPRM1ALDH1A1TDP1DNM1MEN1
Hydrochloric Acid SCHEMBL11827994 0.77 DNM1 (0.48) OPRM1ALDH1A1TDP1DNM1MEN1

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-2001092420-A2 PERYLENE DYES WITH PERSISTENT FLUORESCENCE CAUSED BY STERIC INHIBITION OF AGGREGATION RADIANT COLOR N.V. (BE) 2001-12-06 WO disclosed