SCHEMBL7939157

SCHEMBL7939157

CC1C(c2ccccc2)=C(C2=C(c3cc(C(F)(F)F)cc(C(F)(F)F)c3)[CH]c3ccccc32)c2ccccc21

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 8/20 0.34
CNR1 P21554 1/20 0.31
CNR2 P34972 1/20 0.31
TDP1 Q9NUW8 1/20 0.30
HTR1A P08908 1/20 0.30
HTR7 P34969 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
SCHEMBL7939166 0.95 HTR1A (0.31) TACR1HTR1AHTR7
SCHEMBL7937964 0.89 RXRA (0.32)
SCHEMBL7926988 0.86 DRD2 (0.31)
Hydrochloric Acid SCHEMBL6924045 0.80 TACR1 (0.37) TACR1HTR1AHTR7
Hydrochloric Acid SCHEMBL6927670 0.80 TACR1 (0.34) TACR1HTR1AHTR7
Hydrochloric Acid SCHEMBL6930149 0.80 TACR1 (0.37) TACR1HTR1AHTR7
Hydrochloric Acid SCHEMBL6927007 0.80 TACR1 (0.34) TACR1HTR1AHTR7
Hydrochloric Acid SCHEMBL7133093 0.76 TACR1 (0.34) TACR1HTR1AHTR7
Hydrochloric Acid SCHEMBL7526331 0.76 HTR1A (0.32) TACR1HTR1AHTR7
SCHEMBL8366201 0.71 TACR1 (0.32) TACR1CNR1CNR2HTR1AHTR7

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
US-20010049425-A1 High-melting polyolefin copolymer elastomers, catalysts and methods of synthesis BP CORPORATION NORTH AMERICA INC. 2001-12-06 US claimed