SCHEMBL24409348

SCHEMBL24409348

Cn1nc(CCC(=O)O)cc1-c1ccc(F)cc1Cl

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 1/20 0.52
RXRA P19793 10/20 0.51
RXRB P28702 10/20 0.51
RXRG P48443 10/20 0.51
P2RX7 Q99572 2/20 0.43
FFAR4 Q5NUL3 1/20 0.39
FABP3 P05413 1/20 0.38
HSD11B1 P28845 1/20 0.38
FFAR1 O14842 1/20 0.38
PPARG P37231 1/20 0.38
TBXA2R P21731 1/20 0.38
SCN10A Q9Y5Y9 1/20 0.37
KDM4E B2RXH2 1/20 0.37
USP2 O75604 1/20 0.37
ALDH1A1 P00352 1/20 0.37
ALOX15 P16050 1/20 0.37
MAPK1 P28482 1/20 0.37
HSD17B10 Q99714 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL24408949 0.88 NR1H4 (0.54) NR1H4RXRARXRBRXRGFFAR4
SCHEMBL24409072 0.81 NR1H4 (0.72) NR1H4RXRARXRBRXRGKDM4E
SCHEMBL24425232 0.77 NR1H4 (0.62) NR1H4RXRARXRBRXRGKDM4E
SCHEMBL24419459 0.76 NR1H4 (0.52) NR1H4RXRARXRBRXRG
SCHEMBL24425230 0.75 MAPT (0.44) NR1H4RXRARXRBRXRGKDM4E
SCHEMBL24409202 0.74 NR1H4 (0.56) NR1H4RXRARXRBRXRGFFAR4
SCHEMBL24425227 0.74 NR1H4 (0.56) NR1H4RXRARXRBRXRGFFAR4
SCHEMBL24419790 0.74 NR1H4 (0.62) NR1H4RXRARXRBRXRGFFAR1
SCHEMBL28103411 0.73 HSD11B1 (0.50) P2RX7HSD11B1SCN10AKDM4EMAPK1
SCHEMBL24419805 0.72 NR1H4 (0.57) NR1H4RXRARXRBRXRGKDM4E

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
WO-2022096450-A1 USE OF [(1,5-DIPHENYL-1H-PYRAZOL-3-YL)OXY] ACETIC ACID DERIVATIVES AND THEIR SALTS AND COMPOSITIONS CONTAINING THEM, FOR REDUCING PHYTOTOXIC EFFECTS OF AGROCHEMICALS, IN PARTICULAR OF HERBICIDES, IN USEFUL PLANTS AND CROP PLANTS BAYER AKTIENGESELLSCHAFT (DE) 2022-05-12 WO disclosed