SCHEMBL4398041

SCHEMBL4398041

CCCCCCCCCC(CCC(C)C(=O)O)c1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACE2 Q9BYF1 1/20 0.47
LMNA P02545 1/20 0.37
RECQL P46063 1/20 0.37
F2R P25116 1/20 0.36
GPR84 Q9NQS5 3/20 0.36
NR5A2 O00482 1/20 0.36
NR5A1 Q13285 1/20 0.36
KCNH2 Q12809 1/20 0.36
FFAR1 O14842 1/20 0.36
VCAM1 P19320 1/20 0.36
MAPT P10636 1/20 0.36
LCK P06239 1/20 0.36
PPARD Q03181 1/20 0.36
ZDHHC20 Q5W0Z9 1/20 0.36
ZDHHC2 Q9UIJ5 1/20 0.36
GLRA3 O75311 1/20 0.36
GLRB P48167 1/20 0.36
HSPD1 P10809 1/20 0.35
BLM P54132 1/20 0.35
HSPE1 P61604 1/20 0.35

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
SCHEMBL4384128 1.00 ACE2 (0.47) ACE2LMNARECQLF2RGPR84
SCHEMBL4391317 0.99 ACE2 (0.44) ACE2LMNARECQLF2RGPR84
SCHEMBL4395905 0.93 ACE2 (0.41) ACE2LMNAFFAR1PPARD
SCHEMBL4395891 0.93 ACE2 (0.41) ACE2LMNAFFAR1PPARD
SCHEMBL11139415 0.91 ACE2 (0.42) ACE2LMNARECQLF2RGPR84
SCHEMBL27383361 0.86 VCAM1 (0.49) GPR84FFAR1VCAM1PPARDKMT2A
SCHEMBL28432363 0.86 VCAM1 (0.45) LMNARECQLGPR84FFAR1VCAM1
SCHEMBL4398044 0.86 VCAM1 (0.49) GPR84FFAR1VCAM1PPARDKMT2A
SCHEMBL4384130 0.86 VCAM1 (0.49) GPR84FFAR1VCAM1PPARDKMT2A
SCHEMBL5421526 0.86 VCAM1 (0.45) LMNARECQLGPR84FFAR1VCAM1

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
WO-2023008359-A1 MAGNETORHEOLOGICAL FLUID AND MAGNETORHEOLOGICAL FLUID DEVICE 富士フイルム株式会社 2023-02-02 WO disclosed
EP-1862506-B1 ANTISTATIC COMPOSITION ADEKA CORP (JP) 2014-04-30 EP disclosed
US-7629401-B2 Antistatic composition ADEKA CORPORATION (JP) 2009-12-08 US disclosed
US-20080176979-A1 Antistatic Composition ADEKA CORPORATION (JP) 2008-07-24 US disclosed
EP-1862506-A1 ANTISTATIC COMPOSITION Adeka Corporation (JP) 2007-12-05 EP disclosed