SCHEMBL9568480

SCHEMBL9568480

O=P(OCc1ccccc1)(OCc1ccccc1)Oc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.57
MEN1 O00255 1/20 0.50
HTT P42858 1/20 0.50
KMT2A Q03164 1/20 0.50
SRC P12931 2/20 0.47
NR4A1 P22736 1/20 0.46
NR4A2 P43354 1/20 0.46
NR4A3 Q92570 1/20 0.46
TDP1 Q9NUW8 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
ANPEP P15144 1/20 0.45
LAP3 P28838 1/20 0.45
ALDH1A1 P00352 1/20 0.45
MAPT P10636 1/20 0.45
CETP P11597 3/20 0.44
MAOB P27338 1/20 0.43

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
SCHEMBL381492 0.96 TSHR (0.57) TSHRMEN1HTTKMT2ASRC
SCHEMBL6862381 0.92 TSHR (0.52) TSHRMEN1HTTKMT2ASRC
SCHEMBL13875357 0.90 TSHR (0.55) TSHRMEN1KMT2ASRCNR4A1
SCHEMBL8519323 0.89 TSHR (0.50) TSHRMEN1HTTKMT2ASRC
SCHEMBL27726043 0.89 TSHR (0.50) TSHRMEN1HTTKMT2ASRC
SCHEMBL2987983 0.88 NR4A2 (0.65) TSHRMEN1KMT2ANR4A1NR4A2
SCHEMBL6862483 0.87 TSHR (0.47) TSHRMEN1HTTKMT2ASRC
SCHEMBL28671897 0.86 TSHR (0.47) TSHRMEN1HTTKMT2ASRC
SCHEMBL21419139 0.86 TSHR (0.51) TSHRSRCNR4A1NR4A2NR4A3
SCHEMBL4220649 0.86 NR4A2 (0.63) TSHRMEN1KMT2ANR4A1NR4A2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103347859-A Synthesis and Anticancer Activity of Aryl and Heteroaryl Quinoline Derivatives EFFICIENT PHARMA MAN CORP 2013-10-09 CN claimed
CN-115725123-A Method for incorporating graphene into rubber complexes using a liquid plasticizer route-LPR method 福特全球技术公司 2023-03-03 CN disclosed
EP-0531000-A1 Oil additive concentrates and lubricants of enhanced performance capabilities ETHYL PETROLEUM ADDITIVES, INC. (US) 1993-03-10 EP disclosed
EP-0493928-A1 Lubricating oil compositions, concentrates and the use thereof ETHYL PETROLEUM ADDITIVES, INC. (US) 1992-07-08 EP disclosed