SCHEMBL12173358

SCHEMBL12173358

C=CC(=O)OCCCCCOc1ccc(C(=O)Oc2ccc(C)c(F)c2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 3/20 0.44
▸ THRB P10828 1/20 0.43
▸ KMT2A Q03164 3/20 0.43
▸ NPC1 O15118 2/20 0.43
▸ LMNA P02545 2/20 0.43
▸ MAPT P10636 2/20 0.43
▸ NFKB1 P19838 1/20 0.43
▸ NFKB2 Q00653 1/20 0.43
▸ RELA Q04206 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ CYP3A4 P08684 2/20 0.42
▸ TSHR P16473 2/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ POLB P06746 1/20 0.41
▸ APEX1 P27695 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ CYP2D6 P10635 1/20 0.41
▸ CYP2C9 P11712 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41

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
SCHEMBL14366684 0.91 HTT (0.45) HTTTHRBKMT2ANPC1LMNA
SCHEMBL13987041 0.90 LMNA (0.46) HTTTHRBKMT2ANPC1LMNA
SCHEMBL14484259 0.90 THRB (0.46) HTTTHRBKMT2ANPC1LMNA
SCHEMBL13838096 0.89 HTT (0.44) HTTTHRBKMT2ANPC1LMNA
SCHEMBL13837959 0.89 HTT (0.44) HTTTHRBKMT2ANPC1LMNA
SCHEMBL13837992 0.89 HTT (0.44) HTTTHRBKMT2ANPC1LMNA
SCHEMBL13837960 0.89 HTT (0.44) HTTTHRBKMT2ANPC1LMNA
SCHEMBL13838000 0.89 HTT (0.44) HTTTHRBKMT2ANPC1LMNA
SCHEMBL13837944 0.89 HTT (0.44) HTTTHRBKMT2ANPC1LMNA
SCHEMBL13838129 0.89 HTT (0.44) HTTTHRBKMT2ANPC1LMNA

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-20120229734-A1 OPTICAL FILM, OPTICAL COMPENSATION FILM, POLARIZING PLATE AND LIQUID-CRYSTAL DISPLAY DEVICE FUJIFILM CORPORATION (JP) 2012-09-13 — — US disclosed
US-20120229734-A1 OPTICAL FILM, OPTICAL COMPENSATION FILM, POLARIZING PLATE AND LIQUID-CRYSTAL DISPLAY DEVICE FUJIFILM CORPORATION (JP) 2012-09-13 — — US disclosed
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