SCHEMBL10436588

SCHEMBL10436588

CC/C(=C\C(=O)O)C1CC1c1cccc(C(F)(F)F)c1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TRPM5 Q9NZQ8 1/20 0.46
HTR2A P28223 1/20 0.45
HTR2C P28335 1/20 0.45
HTR2B P41595 1/20 0.45
GRM2 Q14416 1/20 0.40
GRM3 Q14832 1/20 0.40
KDM1A O60341 1/20 0.40
RCOR1 Q9UKL0 1/20 0.40
DRD2 P14416 1/20 0.39
GRIN2B Q13224 1/20 0.39
FFAR1 O14842 2/20 0.39
LPAR2 Q9HBW0 1/20 0.39
LMNA P02545 1/20 0.39
MAPT P10636 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HTT P42858 1/20 0.39
KMT2A Q03164 2/20 0.38
ALDH1A1 P00352 1/20 0.38
POLB P06746 1/20 0.38

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
SCHEMBL17104050 0.79 HTR2C (0.52) TRPM5HTR2AHTR2CHTR2BGRM2
SCHEMBL23425315 0.79 HTR2C (0.52) TRPM5HTR2AHTR2CHTR2BGRM2
SCHEMBL8979928 0.79 HTR2C (0.52) TRPM5HTR2AHTR2CHTR2BGRM2
SCHEMBL23116565 0.79 HTR2C (0.52) TRPM5HTR2AHTR2CHTR2BGRM2
SCHEMBL23550027 0.78 HTR2C (0.51) TRPM5HTR2AHTR2CHTR2BGRIN2B
SCHEMBL23550028 0.78 HTR2C (0.51) TRPM5HTR2AHTR2CHTR2BGRIN2B
SCHEMBL23550025 0.78 HTR2C (0.51) TRPM5HTR2AHTR2CHTR2BGRIN2B
SCHEMBL15797739 0.77 SLC18A2 (0.50) TRPM5HTR2AHTR2CHTR2BMAPT
SCHEMBL1011144 0.77 SLC18A2 (0.50) TRPM5HTR2AHTR2CHTR2BMAPT
SCHEMBL15805066 0.77 SLC18A2 (0.50) TRPM5HTR2AHTR2CHTR2BMAPT

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-0369762-A1 Pesticides ROUSSEL-UCLAF (FR) 1990-05-23 EP disclosed