SCHEMBL9909871

SCHEMBL9909871

C=CC(=O)OCCCCOC(=O)Oc1ccc(C(=O)Oc2ccc(OC(=O)c3ccc(OCCCCOC(=O)C=C)cc3)cc2C)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.41
LMNA P02545 2/20 0.41
CYP3A4 P08684 2/20 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
MAPT P10636 3/20 0.40
KMT2A Q03164 3/20 0.40
NFKB1 P19838 1/20 0.40
NFKB2 Q00653 1/20 0.40
RELA Q04206 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
THRB P10828 1/20 0.40
PRSS1 P07477 1/20 0.39
ACR P10323 1/20 0.39
HTT P42858 2/20 0.38
TSHR P16473 2/20 0.36
HPGD P15428 1/20 0.36
TDP1 Q9NUW8 2/20 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
SCHEMBL15306052 1.00 NPC1 (0.41) NPC1LMNACYP3A4CYP1A2CYP2D6
SCHEMBL13337762 0.97 NPC1 (0.41) NPC1LMNACYP3A4CYP1A2CYP2D6
SCHEMBL453621 0.97 MAPT (0.40) NPC1LMNACYP3A4CYP1A2CYP2D6
SCHEMBL29366682 0.97 MAPT (0.40) NPC1LMNACYP3A4CYP1A2CYP2D6
SCHEMBL14072870 0.97 MAPT (0.40) NPC1LMNACYP3A4CYP1A2CYP2D6
SCHEMBL13109509 0.96 ALDH1A1 (0.40) NPC1LMNACYP3A4CYP1A2CYP2D6
SCHEMBL14072873 0.96 ALDH1A1 (0.40) NPC1LMNACYP3A4CYP1A2CYP2D6
SCHEMBL8930224 0.96 ALDH1A1 (0.40) NPC1LMNACYP3A4CYP1A2CYP2D6
SCHEMBL14000691 0.96 ALDH1A1 (0.40) NPC1LMNACYP3A4CYP1A2CYP2D6
SCHEMBL14000706 0.96 MAPT (0.39) NPC1LMNACYP3A4CYP1A2CYP2D6

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230176270-A1 OPTICAL ELEMENT AND METHOD FOR MANUFACTURING THE SAME AGC Inc. (JP) 2023-06-08 US disclosed
US-20210389515-A1 LAMINATE, CIRCULARLY POLARIZING PLATE, AND DISPLAY DEVICE FUJIFILM CORPORATION (JP) 2021-12-16 US disclosed
EP-1540388-B1 RETARDER AND ELLIPTICAL POLARIZING PLATE FUJIFILM CORP (JP) 2012-06-06 EP disclosed