SCHEMBL5554891

SCHEMBL5554891

CCN(Cc1ccccc1)c1[c]cccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.56
CNR2 P34972 3/20 0.47
CYP2C19 P33261 1/20 0.42
ALDH1A1 P00352 4/20 0.41
MGLL Q99685 2/20 0.41
NR1H2 P55055 2/20 0.41
NR1H3 Q13133 2/20 0.41
LMNA P02545 3/20 0.40
AOC3 Q16853 1/20 0.38
MAPT P10636 3/20 0.38
KDM4E B2RXH2 3/20 0.38
MAPK1 P28482 3/20 0.38
TDP1 Q9NUW8 2/20 0.38
MITF O75030 1/20 0.38
HPGD P15428 1/20 0.38
RAD52 P43351 1/20 0.38
KMT2A Q03164 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
PDE4A P27815 1/20 0.37
PDE4B Q07343 1/20 0.37

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
SCHEMBL4535438 0.89 TSHR (0.44) TSHRCNR2CYP2C19ALDH1A1MGLL
SCHEMBL350461 0.85 TSHR (0.38) TSHRCNR2CYP2C19ALDH1A1LMNA
SCHEMBL3467055 0.81 CNR2 (0.40) TSHRCNR2
SCHEMBL6554156 0.78 ALDH1A1 (0.42) TSHRCYP2C19ALDH1A1MGLLLMNA
SCHEMBL1045949 0.78 TSHR (0.48) TSHRALDH1A1MGLLNR1H2NR1H3
SCHEMBL6553728 0.78 ALDH1A1 (0.36) TSHRCNR2ALDH1A1KMT2A
SCHEMBL4722446 0.78 TSHR (0.33) TSHRCNR2ALDH1A1KMT2ATP53
SCHEMBL2456294 0.75 MAPT (0.36) TSHRALDH1A1NR1H2NR1H3LMNA
Bromide SCHEMBL27967621 0.75 TSHR (0.96) TSHRCNR2CYP2C19ALDH1A1MGLL
SCHEMBL7798532 0.74 ALDH1A1 (0.39) TSHRCYP2C19ALDH1A1MGLLLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106746456-A A kind of sludge dehydration device and its method of work based on Controlled by Programmable Controller 徐州工程学院 2017-05-31 CN claimed
CN-106746456-A A kind of sludge dehydration device and its method of work based on Controlled by Programmable Controller 徐州工程学院 2017-05-31 CN disclosed
EP-1803034-A2 HOLOGRAPHIC STORAGE MEDIUM General Electric Company (US) 2007-07-04 EP disclosed
WO-2006044243-A2 HOLOGRAPHIC STORAGE MEDIUM GENERAL ELECTRIC COMPANY A CORPORATION OF THE STATE OF NEW YORK (US) 2006-04-27 WO disclosed
EP-0379200-A2 Photopolymerizable composition MITSUBISHI KASEI CORPORATION (JP) 1990-07-25 EP disclosed