SCHEMBL14926735

SCHEMBL14926735

CNC(=O)/C=C/c1ccc(C)c(C)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PELI1 Q96FA3 3/20 0.52
KDM4E B2RXH2 2/20 0.49
ALDH1A1 P00352 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
MAPT P10636 2/20 0.49
LMNA P02545 2/20 0.49
POLB P06746 1/20 0.49
HSP90AA1 P07900 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
BACE1 P56817 1/20 0.46
IP6K1 Q92551 1/20 0.46
IP6K3 Q96PC2 1/20 0.46
IP6K2 Q9UHH9 1/20 0.46
MMP1 P03956 5/20 0.46
MMP2 P08253 5/20 0.46
MMP9 P14780 5/20 0.46
KMT2A Q03164 2/20 0.44
CYP1A2 P05177 3/20 0.43
CYP3A4 P08684 2/20 0.43
CYP2D6 P10635 2/20 0.43

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
SCHEMBL25673390 0.86 PELI1 (0.57) PELI1KDM4EALDH1A1MAPTLMNA
SCHEMBL14926733 0.85 PELI1 (0.49) PELI1KDM4EALDH1A1MAPTPOLB
SCHEMBL14926734 0.85 PYGL (0.53) PELI1SMN1; SMN2MAPTLMNAKMT2A
SCHEMBL13681548 0.83 CYP1A2 (0.50) PELI1BACE1IP6K1IP6K3IP6K2
SCHEMBL13226382 0.82 NFE2L2 (0.55) PELI1KDM4EALDH1A1SMN1; SMN2MAPT
SCHEMBL14930446 0.82 NFE2L2 (0.55) PELI1KDM4EALDH1A1SMN1; SMN2MAPT
SCHEMBL12808784 0.80 CYP1A2 (0.67) PELI1CYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL13392807 0.79 RAB9A (0.60) KDM4EALDH1A1SMN1; SMN2MAPTLMNA
SCHEMBL111230 0.79 KDM4E (0.58) KDM4EALDH1A1SMN1; SMN2MAPTLMNA
SCHEMBL14926305 0.79 RAB9A (0.60) KDM4EALDH1A1SMN1; SMN2MAPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9340634-B2 Polymer for use in liquid crystal alignment layer DIC CORPORATION (JP) 2016-05-17 US disclosed
US-9340634-B2 Polymer for use in liquid crystal alignment layer DIC CORPORATION (JP) 2016-05-17 US disclosed
US-20130116396-A1 POLYMER FOR USE IN LIQUID CRYSTAL ALIGNMENT LAYER DIC CORPORATION (JP) 2013-05-09 US disclosed
US-20130116396-A1 POLYMER FOR USE IN LIQUID CRYSTAL ALIGNMENT LAYER DIC CORPORATION (JP) 2013-05-09 US disclosed