SCHEMBL10824468

SCHEMBL10824468

CC(CC1OCCc2ccccc21)NCc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.50
MAPT P10636 4/20 0.48
KMT2A Q03164 3/20 0.46
MEN1 O00255 2/20 0.46
RAB9A P51151 1/20 0.46
BLM P54132 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
GAA P10253 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
TSHR P16473 1/20 0.44
RECQL P46063 1/20 0.44
SIGMAR1 Q99720 1/20 0.44
LMNA P02545 1/20 0.43
CYP2D6 P10635 2/20 0.41
XBP1 P17861 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2C19 P33261 1/20 0.41
KDM4C Q9H3R0 1/20 0.39
TAAR1 Q96RJ0 2/20 0.39
THRB P10828 1/20 0.39

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
SCHEMBL9684807 0.83 ALDH1A1 (0.47) ALDH1A1MAPTKMT2AMEN1RAB9A
SCHEMBL9684696 0.81 ALDH1A1 (0.44) ALDH1A1MAPTKMT2AMEN1RAB9A
SCHEMBL9683704 0.81 ALDH1A1 (0.44) ALDH1A1MAPTKMT2AMEN1RAB9A
SCHEMBL9683619 0.81 ALDH1A1 (0.44) ALDH1A1MAPTKMT2AMEN1RAB9A
SCHEMBL13588569 0.79 MAPT (0.50) ALDH1A1MAPTKMT2AMEN1RAB9A
SCHEMBL28189241 0.77 ALDH1A1 (0.45) ALDH1A1MAPTKMT2AMEN1RAB9A
SCHEMBL7399387 0.76 ALDH1A1 (0.46) ALDH1A1MAPTKMT2AMEN1RAB9A
SCHEMBL9684761 0.76 MAPT (0.40) ALDH1A1MAPTKMT2AMEN1RAB9A
SCHEMBL9683608 0.76 XBP1 (0.47) ALDH1A1MAPTKMT2AMEN1RAB9A
SCHEMBL9684731 0.76 ADRB2 (0.44) ALDH1A1MAPTKMT2AMEN1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-61083180-A None JP disclosed
JP-S6183180-A ISOCHROMAN DERIVATIVE AND ITS PREPARATION MORISHITA SEIYAKU KK 1986-04-26 JP disclosed