SCHEMBL8054522

SCHEMBL8054522

CCCCCCCCCCCCCCCC=CC(O)Cc1ncc[nH]1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
CYP3A4 P08684 1/20 0.40
SPHK2 Q9NRA0 4/20 0.40
SPHK1 Q9NYA1 4/20 0.40
CETP P11597 3/20 0.40
MAPT P10636 3/20 0.38
GMNN O75496 2/20 0.38
LMNA P02545 2/20 0.38
GLA P06280 2/20 0.38
POLB P06746 2/20 0.38
THRB P10828 2/20 0.38
MAPK1 P28482 2/20 0.38
CXCR5 P32302 2/20 0.38
CCR6 P51684 2/20 0.38
BLM P54132 2/20 0.38
UBE2N P61088 2/20 0.38
CYP2D6 P10635 2/20 0.38
ALDH1A1 P00352 1/20 0.38
TP53 P04637 1/20 0.38

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
SCHEMBL83281 0.77 FAAH (0.40) CYP2D6FAAHCES1TBXAS1
SCHEMBL27191621 0.77 TBXAS1 (0.50) FAAHCES1TBXAS1
SCHEMBL18262817 0.77 TBXAS1 (0.50) FAAHCES1TBXAS1
SCHEMBL10775045 0.77 ADA (0.36) CYP3A4CYP2D6CYP1A2CYP2C9ALOX15
SCHEMBL9115484 0.75 TAAR1 (0.37) CYP3A4CYP2D6CYP1A2CYP2C9ALOX15
SCHEMBL28838265 0.73 TAAR1 (0.37) MEN1KMT2ACYP3A4CYP2D6TP53
SCHEMBL4186579 0.73 TBXAS1 (0.45) MEN1KMT2ACYP3A4MAPTLMNA
Ammonia Solution, Strong SCHEMBL29140809 0.72 TAAR1 (0.36) MEN1KMT2ACYP3A4CYP2D6TP53
SCHEMBL9443992 0.72 TAAR1 (0.37) CYP3A4LMNACYP2D6CYP1A2CYP2C9
SCHEMBL2037587 0.72 TAAR1 (0.37) CYP3A4LMNACYP2D6CYP1A2CYP2C9

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-6022383-A Processes for coloring leather by an ink-jet printing method using anionic coloring agents and cationic agents, and leather products obtained therewith CANON KABUSHIKI KAISHA (JP) 2000-02-08 US claimed