SCHEMBL28001775

SCHEMBL28001775

O=C1CCC(=O)N1O.O=P(O)(Oc1ccccc1)Oc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ SRC P12931 1/20 0.50
▸ TDP1 Q9NUW8 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ POLB P06746 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ CES2 O00748 1/20 0.39
▸ CES1 P23141 1/20 0.39
▸ GPR84 Q9NQS5 1/20 0.38
▸ ALOX12 P18054 1/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ ANPEP P15144 2/20 0.37
▸ LAP3 P28838 2/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ MAPK1 P28482 1/20 0.36

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
SCHEMBL37038 0.81 SRC (0.73) SRCTDP1L3MBTL1POLBALDH1A1
Benzene SCHEMBL11142811 0.81 SRC (0.73) SRCTDP1L3MBTL1POLBALDH1A1
SCHEMBL27676341 0.81 SRC (0.73) SRCTDP1L3MBTL1POLBALDH1A1
Hydrochloric Acid SCHEMBL258126 0.79 SRC (0.70) SRCTDP1L3MBTL1POLBALDH1A1
SCHEMBL638996 0.79 SRC (0.70) SRCTDP1L3MBTL1POLBALDH1A1
SCHEMBL23241864 0.79 SRC (0.70) SRCTDP1L3MBTL1POLBALDH1A1
SCHEMBL672896 0.79 SRC (0.70) SRCTDP1L3MBTL1POLBALDH1A1
SCHEMBL7198391 0.79 SRC (0.70) SRCTDP1L3MBTL1POLBALDH1A1
Phosphoric Acid SCHEMBL4948424 0.79 SRC (0.70) SRCTDP1L3MBTL1POLBALDH1A1
Phosphoric Acid SCHEMBL8142468 0.79 SRC (0.70) SRCTDP1L3MBTL1POLBALDH1A1

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-112138001-A Quercetin-low molecular weight heparin-paclitaxel conjugate, preparation method and application 山东大学 2020-12-29 — — CN claimed
CN-104324384-A Hyaluronic acid-quercetin conjugate self-assembly micelle preparation and preparation method thereof UNIV SHANDONG 2015-02-04 — — CN claimed
CN-112138001-A Quercetin-low molecular weight heparin-paclitaxel conjugate, preparation method and application 山东大学 2020-12-29 — — CN disclosed
CN-104324384-A Hyaluronic acid-quercetin conjugate self-assembly micelle preparation and preparation method thereof UNIV SHANDONG 2015-02-04 — — CN disclosed
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