SCHEMBL17431012

SCHEMBL17431012

O=C(Oc1ccc(OC(F)(F)F)cc1)c1ccc(OCOCC2CCC3OC3C2)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGIR P43119 1/20 0.37
▸ CNR1 P21554 1/20 0.36
▸ CNR2 P34972 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ PARP15 Q460N3 1/20 0.36
▸ PARP10 Q53GL7 1/20 0.36
▸ PARP2 Q9UGN5 1/20 0.36
▸ GCGR P47871 1/20 0.36
▸ GIPR P48546 1/20 0.36
▸ EPHX2 P34913 4/20 0.35
▸ PTGER2 P43116 1/20 0.35
▸ HSD11B1 P28845 1/20 0.35
▸ KDM2B Q8NHM5 1/20 0.35
▸ MGLL Q99685 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ PPARD Q03181 1/20 0.35
▸ PPARA Q07869 1/20 0.35
▸ HRH3 Q9Y5N1 1/20 0.34

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
SCHEMBL12730862 0.93 PARP15 (0.43) CNR1CNR2TDP1PARP15PARP10
SCHEMBL16172290 0.92 PARP15 (0.41) PARP15PARP10PARP2KDM4EALDH1A1
SCHEMBL12730655 0.85 LMNA (0.43) PARP15PARP10PARP2KDM4EALDH1A1
SCHEMBL12730687 0.85 LMNA (0.43) PARP15PARP10PARP2KDM4EALDH1A1
SCHEMBL12730656 0.85 MAPT (0.40) PARP15PARP10PARP2KDM4EALDH1A1
SCHEMBL12730669 0.85 LMNA (0.43) PARP15PARP10PARP2KDM4EALDH1A1
SCHEMBL17431013 0.84 MAPT (0.41) PTGIRTDP1KDM4EALDH1A1
SCHEMBL12730659 0.84 NPC1 (0.44) PARP15PARP10PARP2KDM4EALDH1A1
SCHEMBL12730657 0.84 NPC1 (0.44) PARP15PARP10PARP2KDM4EALDH1A1
SCHEMBL12730732 0.83 NPC1 (0.41) EPHX2PPARDPPARA

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-20160011349-A1 INFRARED REFLECTING FILM AND LAMINATED FILM JNC PETROCHEMICAL CORPORATION (JP) 2016-01-14 — — US disclosed
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