SCHEMBL27596144

SCHEMBL27596144

C=CC(=O)Oc1cc(C)ccc1C=CC(=O)c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.53
NPC1 O15118 4/20 0.53
RAB9A P51151 3/20 0.53
ALDH1A1 P00352 2/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
LMNA P02545 3/20 0.52
BCHE P06276 1/20 0.52
CYP3A4 P08684 2/20 0.49
HPGD P15428 2/20 0.49
TYR P14679 1/20 0.46
CYP1B1 Q16678 2/20 0.46
CYP1A2 P05177 1/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
RECQL P46063 1/20 0.45
GPR55 Q9Y2T6 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.44
CYP1A1 P04798 1/20 0.43
NR1H4 Q96RI1 1/20 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
SCHEMBL28200354 0.84 MAPT (0.64) MAPTNPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL3104816 0.82 MAPT (0.55) MAPTNPC1RAB9AALDH1A1LMNA
SCHEMBL27591346 0.78 NFE2L2 (0.61) MAPTNPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL15631499 0.77 CYP1B1 (0.68) MAPTNPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL27594240 0.77 CYP1B1 (0.68) MAPTNPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL27671452 0.76 MAPT (0.52) MAPTALDH1A1SMN1; SMN2LMNACYP3A4
SCHEMBL1576617 0.76 TYR (0.72) MAPTNPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL1576614 0.76 TYR (0.72) MAPTNPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL15339207 0.75 TNFRSF1A (0.49) MAPTNPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL6144936 0.74 MAPT (0.58) MAPTNPC1RAB9AALDH1A1SMN1; SMN2

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
CN-1450394-B Optical alignment method and liquid crystal display element JSR CORP 2010-04-28 CN disclosed
CN-1450394-A Optical alignment method and liquid crystal display element JSR CORP (JP) 2003-10-22 CN disclosed