SCHEMBL7052463

SCHEMBL7052463

[NH]Cc1cccc(SC(F)(F)F)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPRZ1 P23471 4/20 0.41
PTPN1 P18031 2/20 0.41
CETP P11597 2/20 0.40
FFAR4 Q5NUL3 1/20 0.38
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
UBE2M P61081 1/20 0.36
DCUN1D1 Q96GG9 1/20 0.36
MAPT P10636 2/20 0.35
ATM Q13315 1/20 0.35
TRPV1 Q8NER1 5/20 0.35
LMNA P02545 1/20 0.34
TSHR P16473 1/20 0.34
MAPK1 P28482 1/20 0.34
HTT P42858 1/20 0.34
HTR2C P28335 1/20 0.33
HTR6 P50406 1/20 0.33
KCNH2 Q12809 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL1295715 0.81 FFAR4 (0.42) PTPRZ1PTPN1CETPFFAR4KDM4E
SCHEMBL3278395 0.81 CETP (0.42) PTPRZ1PTPN1CETPFFAR4KDM4E
SCHEMBL2692232 0.81 CETP (0.42) PTPRZ1PTPN1CETPFFAR4KDM4E
SCHEMBL5729617 0.81 PNMT (0.44) PTPRZ1PTPN1CETPFFAR4KDM4E
SCHEMBL934510 0.81 PTPRZ1 (0.41) PTPRZ1PTPN1CETPFFAR4KDM4E
SCHEMBL5422754 0.81 PTPRZ1 (0.41) PTPRZ1PTPN1CETPFFAR4KDM4E
SCHEMBL12300586 0.81 CETP (0.41) PTPRZ1PTPN1CETPFFAR4KDM4E
SCHEMBL4039392 0.81 CETP (0.42) PTPRZ1PTPN1CETPFFAR4KDM4E
SCHEMBL26622195 0.80 CETP (0.40) PTPRZ1PTPN1CETPFFAR4KDM4E
Hydrochloric Acid SCHEMBL25368843 0.79 PNMT (0.42) PTPRZ1PTPN1CETPFFAR4KDM4E

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
EP-0882715-B1 NOVEL N-(UNSUBSTITUTED OR SUBSTITUTED)-4-SUBSTITUTED-6-(UNSUBSTITUTED OR SUBSTITUTED)PHENOXY-2-PYRIDINECARBOXAMIDES OR THIOCARBOXAMIDES, PROCESSES FOR PRODUCING THE SAME, AND HERBICIDES KUREHA CHEMICAL IND CO LTD (JP) 2003-04-23 EP disclosed
US-6339045-B1 CAN BE USED IN A SMALL AMOUNT, SHOWING A GOOD SELECTIVITY BETWEEN CROP AND WEED, AND CAUSING NO PHYTOTOXICITY KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 2002-01-15 US disclosed
EP-0882715-A1 NOVEL N-(UNSUBSTITUTED OR SUBSTITUTED)-4-SUBSTITUTED-6-(UNSUBSTITUTED OR SUBSTITUTED)PHENOXY-2-PYRIDINECARBOXAMIDES OR THIOCARBOXAMIDES, PROCESSES FOR PRODUCING THE SAME, AND HERBICIDES KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1998-12-09 EP disclosed