SCHEMBL31306483

SCHEMBL31306483

O=C(COc1ccccc1P(=O)(O)O)NCC(F)(F)c1cc(F)cc(F)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.56
YWHAB P31946 1/20 0.56
PDK1 Q15118 1/20 0.56
SFN P31947 1/20 0.45
PTK2B Q14289 2/20 0.44
ALPG P10696 1/20 0.44
POLB P06746 3/20 0.44
L3MBTL1 Q9Y468 3/20 0.44
KDM4E B2RXH2 1/20 0.44
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.42
ALDH1A1 P00352 1/20 0.42
HSD17B10 Q99714 1/20 0.40
MAPT P10636 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
PTPRC P08575 1/20 0.36
PTPN2 P17706 1/20 0.36
PTPN1 P18031 1/20 0.36
PTPRB P23467 1/20 0.36

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
SCHEMBL31306477 0.91 ESR1 (0.54) ESR1YWHABPDK1SFNPTK2B
SCHEMBL31306496 0.91 ESR1 (0.58) ESR1YWHABPDK1SFNPTK2B
SCHEMBL31306491 0.87 ESR1 (0.54) ESR1YWHABPDK1SFNPTK2B
SCHEMBL31306445 0.85 ESR1 (0.55) ESR1YWHABPDK1SFNPTK2B
SCHEMBL31306463 0.84 ESR1 (0.51) ESR1YWHABPDK1SFNPTK2B
SCHEMBL31306465 0.84 ESR1 (0.56) ESR1YWHABPDK1SFNPTK2B
SCHEMBL31306475 0.84 ESR1 (0.56) ESR1YWHABPDK1SFNPTK2B
SCHEMBL31306488 0.84 ESR1 (0.53) ESR1YWHABPDK1SFNPTK2B
SCHEMBL31306441 0.84 ESR1 (0.53) ESR1YWHABPDK1SFNPTK2B
SCHEMBL31306419 0.83 ESR1 (0.54) ESR1YWHABPDK1SFNPTK2B

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-4731634-A1 SMALL-MOLECULE STABILIZERS OF THE CHREBP 14-3-3 INTERACTION Technische Universiteit Eindhoven (NL) 2026-04-29 EP disclosed
WO-2025005795-A1 SMALL-MOLECULE STABILIZERS OF THE CHREBP 14-3-3 INTERACTION TECHNISCHE UNIVERSITEIT EINDHOVEN (NL) 2025-01-02 WO disclosed