SCHEMBL30359384

SCHEMBL30359384

O=C(O)C1=CC=C(c2ccc(C(=O)O)cc2)CC1(C(F)(F)F)C(F)(F)F

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 4/20 0.40
RXRB P28702 4/20 0.40
RXRG P48443 2/20 0.40
BCL2L1 Q07817 1/20 0.39
BAD Q92934 1/20 0.39
PDK2 Q15119 4/20 0.37
SRD5A2 P31213 1/20 0.36
HDAC1 Q13547 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
TP53 P04637 1/20 0.35
TSHR P16473 1/20 0.35
CA1 P00915 2/20 0.35
CA12 O43570 1/20 0.35
CA9 Q16790 1/20 0.35
TTR P02766 1/20 0.35
CYP2C8 P10632 1/20 0.35
CA2 P00918 1/20 0.34
RARA P10276 1/20 0.34
RARB P10826 1/20 0.34
RARG P13631 1/20 0.34

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
SCHEMBL28492399 0.78 TSHR (0.40) RXRARXRBBCL2L1BADSRD5A2
SCHEMBL9617659 0.77 RARB (0.42) RXRARXRBRXRGTP53TSHR
SCHEMBL4454498 0.77 TP53 (0.39) RXRARXRBBCL2L1BADSRD5A2
SCHEMBL437108 0.77 TSHR (0.39) RXRARXRBBCL2L1BADSRD5A2
SCHEMBL1337848 0.71 BCL2L1 (0.42) RXRARXRBRXRGBCL2L1BAD
SCHEMBL28465115 0.67 KIF11 (0.37) PDK2TP53
SCHEMBL17342672 0.64 TSHR (0.46) RXRARXRBBCL2L1BADSRD5A2
SCHEMBL15505012 0.64 TSHR (0.46) RXRARXRBRXRGBCL2L1BAD
SCHEMBL19876977 0.62 TSHR (0.55) RXRARXRBRXRGBCL2L1BAD
Terephthalic Acid SCHEMBL9577834 0.62 TSHR (0.80) RXRARXRBRXRGBCL2L1BAD

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
US-20230139673-A1 RESIN PARTICLE, TONER, DEVELOPER, DEVELOPER STORAGE CONTAINER, RESIN PARTICLE PRODUCING METHOD, TONER PRODUCING METHOD, IMAGE FORMING APPARATUS, AND IMAGE FORMING METHOD RICOH COMPANY, LTD. (JP) 2023-05-04 US disclosed