SCHEMBL8993658

SCHEMBL8993658

CC(N)CCCC(C)CCCN

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.46
LMNA P02545 1/20 0.43
ALDH1A1 P00352 3/20 0.38
TDP1 Q9NUW8 1/20 0.38
TP53 P04637 1/20 0.37
TRPV1 Q8NER1 1/20 0.33
TRPA1 O75762 1/20 0.33
BLM P54132 1/20 0.32
GABRP O00591 2/20 0.32
GABRD O14764 2/20 0.32
GABRA1 P14867 2/20 0.32
GABRB1 P18505 2/20 0.32
GABRG2 P18507 2/20 0.32
GABRB3 P28472 2/20 0.32
GABRA5 P31644 2/20 0.32
GABRA3 P34903 2/20 0.32
GABRA2 P47869 2/20 0.32
GABRB2 P47870 2/20 0.32
GABRA4 P48169 2/20 0.32
GABRE P78334 2/20 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
SCHEMBL29129032 0.92 OPRM1 (0.50) OPRM1LMNAALDH1A1TDP1TP53
SCHEMBL29077820 0.90 OPRM1 (0.48) OPRM1LMNATP53TRPV1TRPA1
SCHEMBL9329760 0.90 OPRM1 (0.40) OPRM1LMNAALDH1A1TDP1TP53
SCHEMBL82877 0.89
SCHEMBL17738838 0.89
SCHEMBL726430 0.89
Hydrochloric Acid SCHEMBL18281244 0.86 OPRM1 (0.52) OPRM1ALDH1A1TDP1TP53TRPV1
Hydrochloric Acid SCHEMBL3886530 0.86
SCHEMBL1146663 0.86 LMNA (0.47) LMNAALDH1A1BLM
Diaminooctane SCHEMBL9806758 0.85 DNM1 (0.38) OPRM1LMNAALDH1A1TRPV1TRPA1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0463932-B1 Aromatic copolyamides and a process for producing them SHOWA SHELL SEKIYU (JP) 1996-08-07 EP disclosed
US-5235030-A Aromatic copolyamide from naphthalene dicarboxylic acids SHOWA SHELL SEKIYU KABUSHIKI KAISHA (JP) 1993-08-10 US disclosed
EP-0463932-A1 Aromatic copolyamides and a process for producing them Showa Shell Sekiyu Kabushiki Kaisha (JP) 1992-01-02 EP disclosed