SCHEMBL8022960

SCHEMBL8022960

CC1CCC(COc2cc(F)c(C(=O)Oc3cc(F)c(F)c(F)c3)c(F)c2)CC1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PARP10 Q53GL7 3/20 0.41
PARP15 Q460N3 2/20 0.41
SCN9A Q15858 5/20 0.40
HPGD P15428 1/20 0.38
KAT6A Q92794 4/20 0.36
PARP2 Q9UGN5 1/20 0.36
FFAR4 Q5NUL3 1/20 0.35
FFAR1 O14842 2/20 0.34
PPARD Q03181 2/20 0.34
ACACB O00763 1/20 0.34
ACACA Q13085 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
SCHEMBL8022958 1.00 PARP10 (0.41) PARP10PARP15SCN9AHPGDKAT6A
SCHEMBL8027774 0.90 PARP10 (0.41) PARP10PARP15SCN9AKAT6APARP2
SCHEMBL8027771 0.90 PARP10 (0.41) PARP10PARP15SCN9AKAT6APARP2
SCHEMBL8004625 0.88 PARP10 (0.38) PARP10PARP15SCN9AHPGDKAT6A
SCHEMBL8021413 0.88 PARP10 (0.39) PARP10PARP15SCN9AKAT6APARP2
SCHEMBL8021412 0.88 PARP10 (0.39) PARP10PARP15SCN9AKAT6APARP2
SCHEMBL8024438 0.87 PARP10 (0.39) PARP10PARP15SCN9AKAT6APARP2
SCHEMBL8011746 0.86 PARP10 (0.38) PARP10PARP15SCN9AKAT6APARP2
SCHEMBL8011747 0.86 PARP10 (0.38) PARP10PARP15SCN9AKAT6APARP2
SCHEMBL8021673 0.85 PARP10 (0.49) PARP10PARP15SCN9AHPGDKAT6A

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-6149990-A Carboxylate derivatives comprising an ether group and liquid crystal composition comprising the same CHISSO CORPORATION (JP) 2000-11-21 US disclosed
EP-0884302-A1 CARBOXYLIC ESTER DERIVATIVES CONTAINING ETHER GROUP AND LIQUID-CRYSTAL COMPOSITION CONTAINING THE SAME CHISSO CORPORATION (JP) 1998-12-16 EP disclosed