SCHEMBL25933560

SCHEMBL25933560

O=P(Oc1ccccc1)(Oc1ccccc1)Oc1ccc2ccc(OP(=O)(Oc3ccccc3)Oc3ccccc3)cc2c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.56
CYP3A4 P08684 1/20 0.47
TSHR P16473 1/20 0.47
SRC P12931 1/20 0.47
L3MBTL1 Q9Y468 3/20 0.45
TDP1 Q9NUW8 2/20 0.45
CETP P11597 1/20 0.43
CYP1A2 P05177 1/20 0.42
CYP2A6 P11509 1/20 0.42
PTPN7 P35236 1/20 0.42
MEN1 O00255 1/20 0.42
MAPT P10636 1/20 0.42
KMT2A Q03164 1/20 0.42
KDM4E B2RXH2 1/20 0.41
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA9 Q16790 1/20 0.40
ALOX5 P09917 1/20 0.40
MAPK1 P28482 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39

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
SCHEMBL184370 0.96 GPR84 (0.61) GPR84CYP3A4TSHRSRCL3MBTL1
SCHEMBL30516988 0.96 GPR84 (0.61) GPR84CYP3A4TSHRSRCL3MBTL1
SCHEMBL184120 0.96 GPR84 (0.61) GPR84CYP3A4TSHRSRCL3MBTL1
SCHEMBL9622257 0.96 GPR84 (0.55) GPR84CYP3A4TSHRSRCL3MBTL1
SCHEMBL7768954 0.92 GPR84 (0.66) GPR84CYP3A4TSHRTDP1CETP
SCHEMBL2546495 0.90 GPR84 (0.68) GPR84CYP3A4TSHRTDP1CETP
SCHEMBL3680808 0.87 GPR84 (0.56) GPR84CYP3A4TSHRTDP1CETP
SCHEMBL3682011 0.87 GPR84 (0.56) GPR84CYP3A4TSHRTDP1CETP
SCHEMBL131239 0.85 CYP3A4 (0.61) CYP3A4TSHRSRCL3MBTL1TDP1
SCHEMBL10015247 0.85 CYP3A4 (0.61) CYP3A4TSHRSRCL3MBTL1TDP1

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
US-20230242830-A1 USE OF OILS COMPRISING NON-NEUROTOXIC ANTI-WEAR ADDITIVES NYCO (FR) 2023-08-03 US disclosed
US-20230242830-A1 USE OF OILS COMPRISING NON-NEUROTOXIC ANTI-WEAR ADDITIVES NYCO (FR) 2023-08-03 US disclosed