SCHEMBL21767977

SCHEMBL21767977

CCS(=O)(=O)c1cc2ccc(C(F)(F)F)cc2nc1C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 8/20 0.41
DDR1 Q08345 3/20 0.39

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
SCHEMBL29628213 0.85 MAOB (0.47) PTGDR2
SCHEMBL21767975 0.85 MAOB (0.47) PTGDR2
SCHEMBL29286640 0.78 ALDH1A1 (0.54)
SCHEMBL21774480 0.78 DDR1 (0.39) PTGDR2DDR1
SCHEMBL17941413 0.77 CFTR (0.42)
SCHEMBL17802318 0.74 ALDH1A1 (0.40) DDR1
SCHEMBL16346453 0.74 AGBL2 (0.46) DDR1
SCHEMBL29033896 0.74 KDM4E (0.53) PTGDR2DDR1
SCHEMBL24725980 0.70 PPARD (0.47)
SCHEMBL24212299 0.69 AGBL2 (0.36) DDR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3617207-B1 CONDENSED HETEROCYCLIC COMPOUND OR SALT THEREOF, AGRICULTURAL AND HORTICULTURAL INSECTICIDE COMPRISING THE COMPOUND OR THE SALT, AND METHOD FOR USING THE INSECTICIDE NIHON NOHYAKU CO LTD (JP) 2023-06-28 EP disclosed
EP-3617207-A1 FUSED HETEROCYCLIC COMPOUND OR SALT THEREOF, AGRICULTURAL OR HORTICULTURAL INSECTICIDE CONTAINING EITHER COMPOUND, AND METHOD FOR USING SAID INSECTICIDE Nihon Nohyaku Co., Ltd. (JP) 2020-03-04 EP disclosed