SCHEMBL6536307

SCHEMBL6536307

CC(=O)Oc1ccc2c(c1)Cc1ccccc1-2

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.58
ALDH1A1 P00352 6/20 0.58
SMN1; SMN2 Q16637 4/20 0.58
HTR2C P28335 2/20 0.55
HTR2B P41595 2/20 0.55
CYP1A2 P05177 1/20 0.55
ADRA2A P08913 1/20 0.55
MAOA P21397 1/20 0.55
SLC6A2 P23975 1/20 0.55
SLC6A4 P31645 1/20 0.55
SRD5A2 P31213 1/20 0.53
KDM4E B2RXH2 3/20 0.51
HPGD P15428 3/20 0.51
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
PKM P14618 1/20 0.49
RAB9A P51151 4/20 0.47
NPC1 O15118 3/20 0.47
LMNA P02545 3/20 0.46
DRD2 P14416 1/20 0.46

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
SCHEMBL12821529 0.94 MAPT (0.58) MAPTALDH1A1SMN1; SMN2HTR2CHTR2B
SCHEMBL6536539 0.92 MAPT (0.53) MAPTALDH1A1SMN1; SMN2KDM4EMEN1
SCHEMBL25524775 0.89 ALDH1A1 (0.69) MAPTALDH1A1SMN1; SMN2HTR2CHTR2B
SCHEMBL17070937 0.85 METAP1 (0.53) MAPTALDH1A1SMN1; SMN2CYP1A2KDM4E
SCHEMBL6536469 0.83 METAP1 (0.45) MAPTALDH1A1SMN1; SMN2SRD5A2KDM4E
SCHEMBL6536297 0.83 MAPT (0.72) MAPTALDH1A1SMN1; SMN2SLC6A2SRD5A2
SCHEMBL10922236 0.80 SRD5A2 (0.49) MAPTALDH1A1SMN1; SMN2HTR2CHTR2B
SCHEMBL15395721 0.80 MAPT (0.50) MAPTALDH1A1SMN1; SMN2HTR2CHTR2B
SCHEMBL5024789 0.79 KDM4E (0.69) MAPTALDH1A1SMN1; SMN2HTR2CHTR2B
SCHEMBL19084240 0.79 BACE1 (0.56) MAPTALDH1A1SMN1; SMN2KDM4EMEN1

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-6824709-B2 A LIQUID CRYSTAL COMPOUND OR LIQUID CRYSTAL POLYMERS, CONTAINING ACRYLATE OR METHACRYLATE FLUORENE GROUP; LIQUID CRYSTAL DISPLAY DEVICE CHISSO CORPORATION (JP) 2004-11-30 US disclosed
US-20030203128-A1 Fluorene derivatives and their polymers JNC PETROCHEMICAL CORPORATION (JP) 2003-10-30 US disclosed
US-4545921-A Liquid crystals having a type A smectic phase THOMSON-CSF (FR) 1985-10-08 US disclosed