SCHEMBL4377576

SCHEMBL4377576

Brc1cccc(C2CC3C=CC2C3)c1

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 8/20 0.56
HTR2A P28223 4/20 0.49
HTR2C P28335 4/20 0.49
HTR2B P41595 4/20 0.49
RCOR1 Q9UKL0 4/20 0.39
HRH3 Q9Y5N1 4/20 0.36
ATM Q13315 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
DRD2 P14416 1/20 0.35
DRD1 P21728 1/20 0.35
DRD4 P21917 1/20 0.35
DRD5 P21918 1/20 0.35
DRD3 P35462 1/20 0.35
SLC6A4 P31645 1/20 0.35
SLC6A3 Q01959 1/20 0.35
MEN1 O00255 1/20 0.35
POLB P06746 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL13025192 0.79 HTR2A (0.49) KDM1AHTR2AHTR2CHTR2B
SCHEMBL912610 0.79 HTR2C (0.49) KDM1AHTR2AHTR2CHTR2BDRD2
SCHEMBL4394382 0.79 HTR2C (0.49) KDM1AHTR2AHTR2CHTR2BRCOR1
SCHEMBL1739265 0.78 KDM1A (0.50) KDM1AHTR2CHTR2BRCOR1SLC6A4
SCHEMBL109753 0.77 MAOB (0.46) KDM1AHTR2AHTR2CHTR2BRCOR1
SCHEMBL10582863 0.77 KDM1A (0.39) KDM1AHTR2AHTR2CHTR2BATM
SCHEMBL4244254 0.76 CHRNB4 (0.35) KDM1AHTR2AHTR2CHTR2BMEN1
SCHEMBL4359326 0.76 SLC5A1 (0.41) KDM1AHTR2AHTR2CHTR2BDRD2
SCHEMBL6234699 0.75 KDM1A (0.38) KDM1AHTR2AHTR2CHTR2BRCOR1
SCHEMBL16530012 0.75 KDM1A (0.38) KDM1AHTR2AHTR2CHTR2BRCOR1

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-2060937-A1 RETARDATION FILM, AND LIQUID CRYSTAL DISPLAY DEVICE USING THE SAME Nippon Oil Corporation (JP) 2009-05-20 EP disclosed