SCHEMBL11067319

SCHEMBL11067319

Cc1c(NC(=O)O)cccc1C(F)(F)F

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAS2R14 Q9NYV8 2/20 0.63
DHODH Q02127 1/20 0.55
HDAC6 Q9UBN7 1/20 0.55
ALDH1A1 P00352 6/20 0.48
POLB P06746 3/20 0.46
KDM4E B2RXH2 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
CNR1 P21554 1/20 0.46
CNR2 P34972 1/20 0.46
TSHR P16473 1/20 0.46
GAA P10253 1/20 0.45
EPHX2 P34913 3/20 0.45
HTT P42858 1/20 0.44
MAPK1 P28482 1/20 0.44
ALOX12 P18054 3/20 0.44
MAPT P10636 2/20 0.44
NPSR1 Q6W5P4 1/20 0.44
HPGD P15428 1/20 0.44
LMNA P02545 1/20 0.43

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
SCHEMBL30152395 0.88 TAS2R14 (0.58) TAS2R14DHODHHDAC6ALDH1A1POLB
SCHEMBL23167346 0.88 TAS2R14 (0.58) TAS2R14DHODHHDAC6ALDH1A1POLB
SCHEMBL985910 0.88 TAS2R14 (0.57) TAS2R14DHODHHDAC6ALDH1A1POLB
SCHEMBL6475387 0.86 TAS2R14 (0.56) TAS2R14DHODHHDAC6ALDH1A1POLB
SCHEMBL5490486 0.85 TAS2R14 (0.59) TAS2R14HDAC6ALDH1A1POLBMEN1
SCHEMBL15761172 0.85 TAS2R14 (0.55) TAS2R14DHODHHDAC6ALDH1A1POLB
SCHEMBL9457765 0.85 TAS2R14 (0.55) TAS2R14DHODHHDAC6ALDH1A1POLB
SCHEMBL30977681 0.85 TAS2R14 (0.55) TAS2R14DHODHHDAC6ALDH1A1POLB
SCHEMBL1847415 0.84 EPHX2 (0.58) TAS2R14ALDH1A1POLBKDM4EMEN1
SCHEMBL26661715 0.84 TAS2R14 (0.45) TAS2R14DHODHHDAC6ALDH1A1POLB

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4433999-A THIOCARBAMATES, CARBAMATE AND AN ANTIDOTE STAUFFER CHEMICAL COMPANY (US) 1984-02-28 US disclosed
US-4299616-A THIOLCARBAMATES IN COMBINATION WITH SUBSTITUTED CARBAMATES STAUFFER CHEMICAL COMPANY (US) 1981-11-10 US disclosed
EP-0038945-A2 Herbicide compositions of extended soil life STAUFFER CHEMICAL COMPANY (US) 1981-11-04 EP disclosed