SCHEMBL11670549

SCHEMBL11670549

COc1ccc(C=Cc2cccc3ccccc23)c2ccccc12

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.60
LMNA P02545 3/20 0.60
CHAT P28329 4/20 0.51
CAPN1 P07384 1/20 0.50
CTSL P07711 1/20 0.50
CTSB P07858 1/20 0.50
ABCB1 P08183 1/20 0.50
MEN1 O00255 1/20 0.49
HPGD P15428 1/20 0.49
KMT2A Q03164 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
NQO1 P15559 1/20 0.48
TP53 P04637 1/20 0.48
PTGS1 P23219 1/20 0.46
PTGS2 P35354 1/20 0.46
BACE1 P56817 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
SCHEMBL11671491 1.00 MAPT (0.60) MAPTLMNACHATCAPN1CTSL
SCHEMBL14422440 0.86 CHAT (0.47) MAPTLMNACHATPTGS1PTGS2
SCHEMBL11670985 0.83 KDM4E (0.56) MAPTLMNACHATHPGDTP53
SCHEMBL11670988 0.83 KDM4E (0.56) MAPTLMNACHATHPGDTP53
SCHEMBL2604950 0.83 MAPT (0.61) MAPTLMNACHATCAPN1CTSL
SCHEMBL2604952 0.82 MAPT (0.79) MAPTLMNACHATCAPN1CTSL
SCHEMBL7915395 0.82 MAPT (0.63) MAPTLMNACHATCAPN1CTSL
SCHEMBL7915398 0.82 MAPT (0.63) MAPTLMNACHATCAPN1CTSL
SCHEMBL2604948 0.81 LMNA (0.68) MAPTLMNACHATCAPN1CTSL
SCHEMBL2604932 0.81 LMNA (0.77) MAPTLMNACHATCAPN1CTSL

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-4004573-A Process and apparatus for solar energy collection and retrieval BATTELLE DEVELOPMENT CORPORATION (US) 1977-01-25 US disclosed
US-4004572-A Solar energy collection and retrieval employing reversible photochemical isomerization BATTELLE DEVELOPMENT CORPORATION (US) 1977-01-25 US disclosed