SCHEMBL7761889

SCHEMBL7761889

CCCCCCCCCC(CN)C(CCCC)CCCC

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.46
TDP1 Q9NUW8 1/20 0.46
DNM1 Q05193 10/20 0.46
OPRM1 P35372 1/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
TSHR P16473 1/20 0.43
EPHX1 P07099 1/20 0.43
SPHK1 Q9NYA1 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
Hydrochloric Acid SCHEMBL10967044 0.98 DNM1 (0.46) ALDH1A1TDP1DNM1OPRM1MEN1
Hydrochloric Acid SCHEMBL11830045 0.95 DNM1 (0.48) ALDH1A1TDP1DNM1OPRM1MEN1
Hydrochloric Acid SCHEMBL11827994 0.95 DNM1 (0.48) ALDH1A1TDP1DNM1OPRM1MEN1
Hydrochloric Acid SCHEMBL11839222 0.95 DNM1 (0.48) ALDH1A1TDP1DNM1OPRM1MEN1
SCHEMBL7766590 0.93 OPRM1 (0.42) ALDH1A1TDP1DNM1OPRM1MEN1
SCHEMBL10887402 0.88 ALDH1A1 (0.44) ALDH1A1TDP1DNM1OPRM1MEN1
SCHEMBL27842225 0.88 ALDH1A1 (0.44) ALDH1A1TDP1DNM1OPRM1MEN1
SCHEMBL12094790 0.88 ALDH1A1 (0.44) ALDH1A1TDP1DNM1OPRM1MEN1
SCHEMBL13006183 0.88 ALDH1A1 (0.50) ALDH1A1TDP1DNM1OPRM1MEN1
SCHEMBL20962950 0.87 DNM1 (0.58) DNM1OPRM1TSHRSPHK1

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