SCHEMBL22504308

SCHEMBL22504308

Cc1cc2ccc3sccc3c2s1

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.46
KDM4E B2RXH2 3/20 0.46
ALDH1A1 P00352 2/20 0.46
GAA P10253 1/20 0.46
HTT P42858 1/20 0.46
TSHR P16473 1/20 0.36
CYP2A6 P11509 3/20 0.34
HTR2A P28223 1/20 0.33
HTR2C P28335 1/20 0.33

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
SCHEMBL26034411 0.91 MAPT (0.40) MAPTKDM4EALDH1A1GAAHTT
SCHEMBL15001039 0.79 ALDH1A1 (0.41) MAPTALDH1A1
SCHEMBL28084378 0.78 MAPT (0.39) MAPTKDM4EALDH1A1GAAHTT
SCHEMBL19130676 0.78 MAPT (0.33) MAPTTSHRCYP2A6
SCHEMBL10441966 0.78 ALDH1A1 (0.33) KDM4EALDH1A1GAACYP2A6
SCHEMBL19412806 0.77 MAPT (0.40) MAPTKDM4EALDH1A1GAAHTT
SCHEMBL15281059 0.76 MAPT (0.35) MAPTKDM4EALDH1A1GAAHTT
SCHEMBL18133641 0.76 MAPT (0.32) MAPTTSHRCYP2A6
SCHEMBL12279085 0.76 MAPT (0.32) MAPTTSHRCYP2A6
SCHEMBL17427785 0.76 ALDH1A1 (0.32) ALDH1A1CYP2A6

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-2020203594-A1 FLUORENE DERIVATIVE AND USE THEREOF 日産化学株式会社 2020-10-08 WO disclosed