SCHEMBL4379258

SCHEMBL4379258

Clc1cccc(Cl)c1C1CC2C=CC1C2

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.44
HTR2C P28335 5/20 0.36
HTR2A P28223 3/20 0.36
HTR2B P41595 2/20 0.36
CYP1A2 P05177 2/20 0.34
CYP2A6 P11509 2/20 0.34
NR4A2 P43354 1/20 0.32
KDM4E B2RXH2 2/20 0.31
TSHR P16473 1/20 0.31
HTR5A P47898 3/20 0.30
HTR1A P08908 2/20 0.30
HTR1D P28221 2/20 0.30
HTR7 P34969 2/20 0.30
HTR3A P46098 1/20 0.30
HTR6 P50406 1/20 0.30
HRH1 P35367 1/20 0.30
IL1B P01584 1/20 0.30
MEN1 O00255 1/20 0.30
GAA P10253 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL1739919 0.81 HTR2A (0.47) SMN1; SMN2HTR2CHTR2AHTR2BKDM4E
SCHEMBL912333 0.71 HTR2A (0.43) HTR2CHTR2AHTR2B
SCHEMBL16530012 0.70 KDM1A (0.38) HTR2CHTR2AHTR2BKDM4ETSHR
SCHEMBL109753 0.69 MAOB (0.46) HTR2CHTR2AHTR2BCYP1A2CYP2A6
SCHEMBL18587144 0.69 CHRNB2 (0.44) HTR2CKDM4ETSHR
SCHEMBL18657320 0.69 SMN1; SMN2 (0.42) SMN1; SMN2HTR2CHTR2AHTR2BCYP1A2
SCHEMBL24969344 0.68 AHR (0.38)
SCHEMBL18587142 0.68 HTR2C (0.37) HTR2CHTR2AHTR2BCYP1A2KDM4E
SCHEMBL21525760 0.67 KDM1A (0.42) HTR2CHTR2AHTR2BKDM4ETSHR
SCHEMBL21525759 0.67 KDM1A (0.42) HTR2CHTR2AHTR2BKDM4ETSHR

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