SCHEMBL28323743

SCHEMBL28323743

OC1c2ccccc2C=CC1c1ccc(F)cc1

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35
PRCP P42785 1/20 0.35
CYP2D6 P10635 1/20 0.34
EPHX1 P07099 2/20 0.32
HTR6 P50406 1/20 0.32
HTR2A P28223 3/20 0.32
HTR2C P28335 2/20 0.31
HTR2B P41595 2/20 0.31
HRH3 Q9Y5N1 2/20 0.31
MMP2 P08253 1/20 0.31
MMP8 P22894 1/20 0.31
ATM Q13315 1/20 0.31

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
SCHEMBL28323744 1.00 GAA (0.35) GAAMAPTPRCPCYP2D6EPHX1
SCHEMBL28323755 0.85 CYP2D6 (0.38) CYP2D6HTR6HTR2AATM
SCHEMBL28323756 0.85 CYP2D6 (0.38) CYP2D6HTR6HTR2AATM
SCHEMBL28876954 0.84 PRCP (0.36) PRCPCYP2D6HTR6HTR2AHTR2C
SCHEMBL28876953 0.84 PRCP (0.36) PRCPCYP2D6HTR6HTR2AHTR2C
SCHEMBL28322709 0.83 RET (0.36) GAAPRCPCYP2D6HTR6
SCHEMBL28322723 0.83 HDAC4 (0.36) GAACYP2D6HTR6HTR2AHTR2C
SCHEMBL28322712 0.83 RET (0.36) GAAPRCPCYP2D6HTR6
SCHEMBL28322722 0.83 HDAC4 (0.36) GAACYP2D6HTR6HTR2AHTR2C
SCHEMBL28323772 0.82 HTR2C (0.35) GAAMAPTCYP2D6HTR2AHTR2C

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
CN-107235843-B A kind of synthetic method of 2- phenyl -1,2- dihydronaphthalene -1- alcohol racemic compound and its derivative 华南师范大学 2019-08-13 CN disclosed