SCHEMBL4338324

SCHEMBL4338324

CCc1ccc2c(c1)Cc1[c]c(C)ccc1-2

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.34
RAB9A P51151 3/20 0.34
NPC1 O15118 2/20 0.34
MAPK1 P28482 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
LMNA P02545 1/20 0.34
MAPT P10636 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
TSHR P16473 2/20 0.33
ATM Q13315 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
TRPA1 O75762 1/20 0.32
HTR2A P28223 1/20 0.32
HTR2C P28335 1/20 0.32
HTR2B P41595 1/20 0.32
PDK2 Q15119 1/20 0.31
CYP1A2 P05177 2/20 0.31
SRD5A1 P18405 1/20 0.31
CYP2A6 P11509 1/20 0.31
KDM4E B2RXH2 1/20 0.31

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
SCHEMBL2035847 0.84 ALDH1A1 (0.34) ALDH1A1RAB9ANPC1MAPK1SMN1; SMN2
SCHEMBL715112 0.80 METAP1 (0.43) ALDH1A1RAB9ANPC1SMN1; SMN2MAPT
SCHEMBL4894905 0.78 ALDH1A1 (0.46) ALDH1A1RAB9ANPC1MAPK1SMN1; SMN2
SCHEMBL216980 0.74 ALDH1A1 (0.40) ALDH1A1RAB9ANPC1SMN1; SMN2LMNA
SCHEMBL2051839 0.73 PTK2 (0.33) ALDH1A1CYP1A2KDM4EPOLBHPGD
SCHEMBL2039541 0.72 CNR1 (0.38) ALDH1A1TSHRATMNPSR1HTR2A
SCHEMBL5357579 0.70 ALDH1A1 (0.59) ALDH1A1RAB9ANPC1MAPK1SMN1; SMN2
SCHEMBL2047276 0.70 BCL2 (0.40) HTR2CHTR2B
SCHEMBL2037493 0.70 SKP2 (0.40) RAB9ANPC1MAPK1SMN1; SMN2NPSR1
SCHEMBL23759836 0.69 METAP1 (0.43) ALDH1A1RAB9ANPC1MAPK1SMN1; 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7592403-B2 Ethylene polymer, preparation process thereof and molded articles of the same MITSUI CHEMICALS, INC. (JP) 2009-09-22 US disclosed
US-20050267273-A1 Ethylene polymer, preparation process thereof and molded articles of the same MITSUI CHEMICALS, INC. 2005-12-01 US disclosed
EP-1231229-A2 Ethylene polymer, preparation process thereof and molded articles of the same Mitsui Chemicals, Inc. (JP) 2002-08-14 EP disclosed
US-20020107343-A1 Ethylene polymer, preparation process thereof and molded articles of the same MITSUI CHEMICALS, INC. 2002-08-08 US disclosed