SCHEMBL9849575

SCHEMBL9849575

CC(Cc1ccccc1F)P(=O)(O)O

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.40
POLB P06746 1/20 0.40
PPARG P37231 1/20 0.39
PPARA Q07869 1/20 0.39
HPGD P15428 1/20 0.39
CYP3A4 P08684 1/20 0.39
TAAR1 Q96RJ0 3/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
GAA P10253 1/20 0.38
PDPK1 O15530 1/20 0.38
SLC1A2 P43004 1/20 0.38
KDM4E B2RXH2 2/20 0.37
DPP4 P27487 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
SCHEMBL3893128 0.80 ACP3 (0.42) ALDH1A1PPARGPPARAHPGDTAAR1
Formic Acid SCHEMBL27702276 0.76 GABRA1 (0.47) ALDH1A1PPARGPPARATAAR1MEN1
SCHEMBL777639 0.76 ACP3 (0.62) PPARGPPARAMEN1KMT2APDPK1
SCHEMBL777515 0.76 ACP3 (0.38) ALDH1A1PPARGPPARAHPGDTAAR1
SCHEMBL4287643 0.75 ACP3 (0.55) ALDH1A1HPGDTAAR1
SCHEMBL14718937 0.75 TAAR1 (0.45) ALDH1A1PPARGPPARACYP3A4TAAR1
SCHEMBL2425148 0.75 TAAR1 (0.45) ALDH1A1PPARGPPARACYP3A4TAAR1
SCHEMBL15082795 0.75 TAAR1 (0.45) ALDH1A1PPARGPPARACYP3A4TAAR1
SCHEMBL777704 0.75 DPP4 (0.38) ALDH1A1PPARGPPARAHPGDCYP3A4
SCHEMBL139640 0.74 GABRA1 (0.52) ALDH1A1CYP3A4TAAR1

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
EP-0427040-A1 Paper-coating compositions comprising whitening agents BAYER AG (DE) 1991-05-15 EP disclosed