SCHEMBL11490482

SCHEMBL11490482

O=C(O)c1cc(Cl)ccc1Oc1cccc(C(F)(F)F)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MPO P05164 1/20 0.58
STK39 Q9UEW8 1/20 0.54
PPARG P37231 5/20 0.53
MRGPRX4 Q96LA9 1/20 0.51
KDM4E B2RXH2 1/20 0.50
POLB P06746 1/20 0.50
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
TTR P02766 1/20 0.49
PPOX P50336 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
GRIK1 P39086 1/20 0.49
SCN9A Q15858 1/20 0.48
CCR1 P32246 1/20 0.47
CCR2 P41597 1/20 0.47
PTGER4 P35408 3/20 0.47
SLC2A1 P11166 1/20 0.46
P2RX1 P51575 1/20 0.46
P2RX4 Q99571 1/20 0.46
P2RX7 Q99572 1/20 0.46

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
SCHEMBL11578390 0.90 PPARG (0.53) MPOSTK39PPARGMRGPRX4KDM4E
SCHEMBL9364630 0.85 MPO (0.57) MPOSTK39MRGPRX4KDM4EPOLB
SCHEMBL4445314 0.84 MRGPRX4 (0.60) MRGPRX4KDM4EPOLBCCR2PTGER4
SCHEMBL6791603 0.83 RXFP1 (0.58) PPARGMRGPRX4KDM4EPOLBMEN1
SCHEMBL30775042 0.83 RXFP1 (0.58) PPARGMRGPRX4KDM4EPOLBMEN1
SCHEMBL9360774 0.83 KDM4E (0.75) PPARGKDM4EPOLBMEN1KMT2A
SCHEMBL4447285 0.82 PTGER4 (0.62) MRGPRX4KDM4EPOLBGRIK1CCR2
SCHEMBL22891351 0.81 CYP1A2 (0.57) MRGPRX4KDM4EPOLBTTRCCR2
SCHEMBL29006568 0.81 PTGER4 (0.46) STK39PPARGMRGPRX4POLBMEN1
SCHEMBL30341614 0.81 PTGER4 (0.46) STK39PPARGMRGPRX4POLBMEN1

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-4242121-A USING A PHENOXYBENZOIC ACID, ITS ESTER OR SALT IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) 1980-12-30 US disclosed