SCHEMBL8973304

SCHEMBL8973304

CCc1ccc(N(c2ccc(C)cc2)c2ccc(-c3ccc(N(c4ccc(C)cc4)c4ccc(CC)cc4)cc3C)c(C)c2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCRTR2 O43614 1/20 0.37
ALDH1A1 P00352 2/20 0.34
TSHR P16473 2/20 0.34
LPL P06858 1/20 0.34
LIPG Q9Y5X9 1/20 0.34
CYP2C19 P33261 1/20 0.34
ALOX5 P09917 1/20 0.34
PTGS1 P23219 1/20 0.34
PTGS2 P35354 1/20 0.34
POLB P06746 1/20 0.34
MAPK1 P28482 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
IDO1 P14902 1/20 0.33
NPC1 O15118 1/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
S100B P04271 1/20 0.33
EGFR P00533 1/20 0.33

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
SCHEMBL8178434 0.94 LPL (0.38) ALDH1A1TSHRLPLLIPGALOX5
SCHEMBL11966917 0.92 RARB (0.36) HCRTR2ALDH1A1TSHRLPLLIPG
SCHEMBL1702280 0.89 ALDH1A1 (0.42) ALDH1A1TSHRLPLLIPGCYP2C19
SCHEMBL14363700 0.88 TP53 (0.43) ALDH1A1TSHRLPLLIPGCYP2C19
SCHEMBL13383799 0.84 TSHR (0.46) HCRTR2ALDH1A1TSHRLPLLIPG
SCHEMBL2632330 0.84 TSHR (0.46) HCRTR2ALDH1A1TSHRLPLLIPG
SCHEMBL13383740 0.84 TSHR (0.46) HCRTR2ALDH1A1TSHRLPLLIPG
SCHEMBL11938108 0.84 TSHR (0.46) HCRTR2ALDH1A1TSHRLPLLIPG
SCHEMBL27109797 0.84 HCRTR2 (0.38) HCRTR2ALDH1A1TSHRLPLLIPG
SCHEMBL1702985 0.81 ALDH1A1 (0.42) ALDH1A1TSHRCYP2C19L3MBTL1LMNA

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
EP-0434368-B1 Electrophotographic imaging members XEROX CORP (US) 1996-04-03 EP disclosed
EP-0434368-A2 Electrophotographic imaging members XEROX CORPORATION (US) 1991-06-26 EP disclosed