SCHEMBL27588183

SCHEMBL27588183

CCCCCCl.Cc1ccc(C=CC(=O)c2ccccc2)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.71
CYP3A4 P08684 3/20 0.71
ALDH1A1 P00352 1/20 0.71
HPGD P15428 1/20 0.71
CYP1B1 Q16678 2/20 0.62
RAB9A P51151 3/20 0.58
KMT2A Q03164 2/20 0.58
NPC1 O15118 1/20 0.58
MAOB P27338 7/20 0.56
MAOA P21397 4/20 0.56
BCHE P06276 4/20 0.54
ACHE P22303 2/20 0.54
PLIN1 O60240 1/20 0.54
LMNA P02545 1/20 0.54
TNFRSF1A P19438 1/20 0.54
RECQL P46063 1/20 0.54
PLIN5 Q00G26 1/20 0.54
ABHD5 Q8WTS1 1/20 0.54
POLB P06746 1/20 0.54
NFKB1 P19838 2/20 0.52

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
Chalcone SCHEMBL6392677 0.92 BCHE (0.65) MAPTCYP3A4ALDH1A1HPGDCYP1B1
Chalcone SCHEMBL6392672 0.92 BCHE (0.65) MAPTCYP3A4ALDH1A1HPGDCYP1B1
4-Chloro Chalcone SCHEMBL6399398 0.90 MAOB (0.71) MAPTCYP3A4ALDH1A1HPGDCYP1B1
4-Chloro Chalcone SCHEMBL6399394 0.90 MAOB (0.71) MAPTCYP3A4ALDH1A1HPGDCYP1B1
SCHEMBL27606021 0.88 MAOB (0.57) MAPTCYP3A4ALDH1A1HPGDCYP1B1
Pentane SCHEMBL28825197 0.85 CYP1B1 (0.82) MAPTCYP3A4ALDH1A1HPGDCYP1B1
SCHEMBL76030 0.84 MAPT (1.00) MAPTCYP3A4ALDH1A1HPGDCYP1B1
SCHEMBL5753797 0.84 MAPT (1.00) MAPTCYP3A4ALDH1A1HPGDCYP1B1
SCHEMBL6200952 0.84 MAPT (1.00) MAPTCYP3A4ALDH1A1HPGDCYP1B1
SCHEMBL6398280 0.82 NPC1 (0.50) MAPTCYP3A4ALDH1A1HPGDCYP1B1

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-1548463-A Epoxy resin polymer, preparation method thereof and liquid crystal alignment layer material containing the same 长兴化学工业股份有限公司 2004-11-24 CN claimed
CN-1548463-A Epoxy resin polymer, preparation method thereof and liquid crystal alignment layer material containing the same 长兴化学工业股份有限公司 2004-11-24 CN disclosed