SCHEMBL4595058

SCHEMBL4595058

CCN(C)CCC=Cc1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 3/20 0.46
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
L3MBTL1 Q9Y468 2/20 0.43
NPC1 O15118 1/20 0.43
CYP19A1 P11511 1/20 0.43
HTR2A P28223 4/20 0.43
NR1I2 O75469 1/20 0.43
DRD2 P14416 1/20 0.43
ADRA2C P18825 1/20 0.43
CNR1 P21554 1/20 0.43
SLC6A2 P23975 1/20 0.43
SLC6A4 P31645 1/20 0.43
ADRA1A P35348 1/20 0.43
OPRK1 P41145 1/20 0.43
SLC6A3 Q01959 1/20 0.43
KCNH2 Q12809 1/20 0.43
EBP Q15125 1/20 0.43
LMNA P02545 1/20 0.43
CYP1A2 P05177 1/20 0.43

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
SCHEMBL1829150 0.85 MEN1 (0.49) SIGMAR1MEN1KMT2AL3MBTL1NPC1
SCHEMBL372984 0.85 MEN1 (0.49) SIGMAR1MEN1KMT2AL3MBTL1NPC1
SCHEMBL187731 0.84 SIGMAR1 (0.49) SIGMAR1MEN1KMT2AL3MBTL1HTR2A
SCHEMBL1828776 0.84 SIGMAR1 (0.49) SIGMAR1MEN1KMT2AL3MBTL1HTR2A
SCHEMBL10676887 0.82 ALDH1A1 (0.39) SIGMAR1L3MBTL1NPC1HTR2ADRD2
SCHEMBL27508625 0.81 SIGMAR1 (0.49) SIGMAR1MEN1KMT2AKCNH2
Hydrochloric Acid SCHEMBL7054889 0.80 SIGMAR1 (0.47) SIGMAR1L3MBTL1KCNH2ATM
Hydrochloric Acid SCHEMBL7057204 0.80 SIGMAR1 (0.47) SIGMAR1L3MBTL1KCNH2ATM
Hydrochloric Acid SCHEMBL7054893 0.80 SIGMAR1 (0.47) SIGMAR1L3MBTL1KCNH2ATM
Hydrochloric Acid SCHEMBL7057198 0.80 SIGMAR1 (0.47) SIGMAR1L3MBTL1KCNH2ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1380604-B1 OIL-EXTENDED RUBBER AND RUBBER COMPOSITION ZEON CORP (JP) 2008-01-02 EP disclosed
US-7045578-B2 Oil extended rubber and rubber composition ZEON CORPORATION (JP) 2006-05-16 US disclosed
US-20040092645-A1 Oil extended rubber and rubber composition ZEON CORPORATION (JP) 2004-05-13 US disclosed
EP-1380604-A1 OIL-EXTENDED RUBBER AND RUBBER COMPOSITION Zeon Corporation (JP) 2004-01-14 EP disclosed
EP-0894825-B1 DIENE POLYMER COMPOSITION, PROCESS FOR THE PREPARATION OF THE SAME, AND RUBBER COMPOSITION CONTAINING THE SAME NIPPON ZEON CO (JP) 2003-07-23 EP disclosed
EP-0882738-B1 DIENE RUBBER, PROCESS FOR PRODUCING THE RUBBER AND RUBBER COMPOSITION CONTAINING THE SAME ZEON CORP (JP) 2002-11-20 EP disclosed
US-6172160-B1 A RUBBER CONTAINING A DIENE POLYMER COMPOSED OF A BRANCHED DIENE POLYMER COMPONENT HAVING ATLEAST THREE BRANCHED DIENE POLYMER CHAINS THROUGH A POLYFUNCTIONAL COUPLING AGENT AND A LINEAR DIENE POLYMER HAVING QUATERNARY AMMONIUM GROUP NIPPON ZEON CO., LTD. (JP) 2001-01-09 US disclosed
US-6147178-A RUBBER COMPRISING DIENE-VINYL AROMATIC COPOLYMER BEARING QUATERNARY AMMONIUM GROUPS; TENSILE STRENGTH, WEAR RESISTANCE, HEAT RESISTANCE, IMPROVED AFFINITY FOR SILICA REINFORCEMENT NIPPON ZEON CO., LTD. (JP) 2000-11-14 US disclosed
EP-0894825-A1 DIENE POLYMER COMPOSITION, PROCESS FOR THE PREPARATION OF THE SAME, AND RUBBER COMPOSITION CONTAINING THE SAME NIPPON ZEON CO., LTD. (JP) 1999-02-03 EP disclosed
EP-0882738-A1 DIENE RUBBER, PROCESS FOR PRODUCING THE RUBBER AND RUBBER COMPOSITION CONTAINING THE SAME NIPPON ZEON CO., LTD. (JP) 1998-12-09 EP disclosed