SCHEMBL11209310

SCHEMBL11209310

CCCNC1Cc2c[nH]c3cccc(c23)C1O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 8/20 0.43
MEN1 O00255 5/20 0.43
KMT2A Q03164 5/20 0.43
HSD17B10 Q99714 4/20 0.43
MAPT P10636 3/20 0.43
KDM4E B2RXH2 2/20 0.43
CYP1A2 P05177 3/20 0.42
ALDH1A1 P00352 3/20 0.42
ALOX15 P16050 2/20 0.42
MAPK1 P28482 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
THRB P10828 1/20 0.42
APEX1 P27695 1/20 0.42
CYP2D6 P10635 7/20 0.41
BLM P54132 2/20 0.41
HTR1A P08908 2/20 0.41
ADRA2A P08913 2/20 0.41
DRD2 P14416 2/20 0.41
ADRA2B P18089 2/20 0.41
ADRA2C P18825 2/20 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
SCHEMBL11210336 0.90 MEN1 (0.45) CYP3A4MEN1KMT2AHSD17B10MAPT
SCHEMBL10815763 0.83 MEN1 (0.46) CYP3A4MEN1KMT2AHSD17B10MAPT
SCHEMBL10814023 0.83 MEN1 (0.46) CYP3A4MEN1KMT2AHSD17B10MAPT
SCHEMBL11206777 0.80 ADRB2 (0.45) CYP3A4MEN1KMT2AHSD17B10MAPT
SCHEMBL10818656 0.73 MEN1 (0.43) CYP3A4MEN1KMT2AHSD17B10MAPT
SCHEMBL11240757 0.73 MEN1 (0.41) CYP3A4MEN1KMT2AHSD17B10MAPT
SCHEMBL11006874 0.73 MEN1 (0.41) CYP3A4MEN1KMT2AHSD17B10MAPT
SCHEMBL11239304 0.73 MEN1 (0.41) CYP3A4MEN1KMT2AHSD17B10MAPT
SCHEMBL10817817 0.73 MEN1 (0.46) CYP3A4MEN1KMT2AHSD17B10MAPT
Hydrochloric Acid SCHEMBL11246213 0.72 MEN1 (0.40) CYP3A4MEN1KMT2AHSD17B10MAPT

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
EP-0091328-A2 Trans-4-aminobenz(c,d)indol-5-ol derivatives, their salts, their preparation, their use as medicaments and compositions containing them ROUSSEL-UCLAF (FR) 1983-10-12 EP disclosed