SCHEMBL14817289

SCHEMBL14817289

O=C(Oc1ccc(O)cc1)c1ccc(OCC2CCC3OC3C2)cc1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ PARP15 Q460N3 4/20 0.46
▸ PARP10 Q53GL7 4/20 0.46
▸ PARP2 Q9UGN5 2/20 0.46
▸ DRD2 P14416 1/20 0.39
▸ DRD4 P21917 1/20 0.39
▸ NR1H4 Q96RI1 1/20 0.38
▸ HSP90AA1 P07900 1/20 0.36
▸ PRSS1 P07477 1/20 0.36
▸ ACR P10323 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ CYP2D6 P10635 1/20 0.36
▸ CYP2C9 P11712 1/20 0.36
▸ CYP2C19 P33261 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
SCHEMBL12787696 0.89 MAPT (0.46) PARP15PARP10PARP2DRD2DRD4
SCHEMBL12730859 0.88 SIGMAR1 (0.45) PARP15PARP10PARP2CYP1A2CYP2D6
SCHEMBL12730858 0.88 LMNA (0.50) PARP15PARP10PARP2PRSS1ACR
SCHEMBL12730774 0.88 PARP15 (0.44) PARP15PARP10PARP2DRD2DRD4
SCHEMBL12730766 0.88 PARP15 (0.44) PARP15PARP10PARP2DRD2DRD4
SCHEMBL12730862 0.87 PARP15 (0.43) PARP15PARP10PARP2DRD2DRD4
SCHEMBL14817248 0.87 PARP15 (0.43) PARP15PARP10PARP2
SCHEMBL16172290 0.87 PARP15 (0.41) PARP15PARP10PARP2DRD2DRD4
SCHEMBL12730656 0.86 MAPT (0.40) PARP15PARP10PARP2PRSS1ACR
SCHEMBL12730687 0.86 LMNA (0.43) PARP15PARP10PARP2PRSS1ACR

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-8404316-B2 Polymerizable liquid crystal compound and its polymer JNC CORPORATION (JP) 2013-03-26 — — US disclosed
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