SCHEMBL3682011

SCHEMBL3682011

O=P(Oc1ccc(-c2ccccc2)cc1)(Oc1ccc(-c2ccccc2)cc1)Oc1ccc2ccccc2c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 2/20 0.56
CETP P11597 1/20 0.43
CYP3A4 P08684 1/20 0.42
TSHR P16473 1/20 0.42
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
TDP1 Q9NUW8 1/20 0.42
PLAU P00749 1/20 0.41
ADAMTS5 Q9UNA0 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA9 Q16790 1/20 0.41
ALOX5 P09917 1/20 0.41
CYP11B1 P15538 1/20 0.41
CYP11B2 P19099 1/20 0.41
ESR1 P03372 2/20 0.40

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
SCHEMBL3680808 1.00 GPR84 (0.56) GPR84CETPCYP3A4TSHRCYP1A2
SCHEMBL184370 0.91 GPR84 (0.61) GPR84CETPCYP3A4TSHRCYP1A2
SCHEMBL30516988 0.91 GPR84 (0.61) GPR84CETPCYP3A4TSHRCYP1A2
SCHEMBL184120 0.91 GPR84 (0.61) GPR84CETPCYP3A4TSHRCYP1A2
SCHEMBL7768954 0.91 GPR84 (0.66) GPR84CETPCYP3A4TSHRCYP1A2
SCHEMBL2546495 0.89 GPR84 (0.68) GPR84CETPCYP3A4TSHRCYP1A2
SCHEMBL25933560 0.87 GPR84 (0.56) GPR84CETPCYP3A4TSHRCYP1A2
SCHEMBL9622257 0.87 GPR84 (0.55) GPR84CETPCYP3A4TSHRCYP1A2
SCHEMBL473247 0.87 CYP3A4 (0.54) CYP3A4TSHRCYP1A2MEN1MAPT
SCHEMBL360818 0.85 CYP3A4 (0.52) CYP3A4TSHRCYP1A2MEN1KMT2A

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-20100168299-A1 Flame-Retardant Polyester Fibers and Preparation Process Thereof DAIHACHI CHEMICAL INDUSTRY CO., LTD. (JP) 2010-07-01 US disclosed
EP-1857586-A1 FLAME-RETARDANT POLYESTER FIBER AND METHOD FOR PRODUCING SAME DAIHACHI CHEMICAL INDUSTRY CO., LTD. (JP) 2007-11-21 EP disclosed