SCHEMBL4277465

SCHEMBL4277465

CC(CBr)C(=O)O.CCCCCCCCCCCSS

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACE2 Q9BYF1 1/20 0.50
LCK P06239 1/20 0.44
PPARD Q03181 1/20 0.44
ZDHHC20 Q5W0Z9 1/20 0.44
ZDHHC2 Q9UIJ5 1/20 0.44
GPR84 Q9NQS5 3/20 0.42
FFAR1 O14842 2/20 0.42
EPHX1 P07099 1/20 0.41
MAPT P10636 2/20 0.41
GMNN O75496 1/20 0.41
TP53 P04637 1/20 0.41
POLB P06746 1/20 0.41
THRB P10828 1/20 0.41
CYP2C9 P11712 1/20 0.41
BLM P54132 1/20 0.41
HSD17B10 Q99714 1/20 0.41
FFAR4 Q5NUL3 1/20 0.39
FDPS P14324 3/20 0.38
CA1 P00915 2/20 0.38
FAAH O00519 1/20 0.38

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
SCHEMBL10784233 0.78 ACE2 (0.50) ACE2LCKPPARDZDHHC20ZDHHC2
SCHEMBL4277468 0.74 MAPT (0.44) LCKPPARDZDHHC20ZDHHC2GPR84
SCHEMBL10305567 0.73
SCHEMBL2223331 0.73 TSHR (0.50) MAPTGMNNTP53POLBTHRB
SCHEMBL2407701 0.73 TSHR (0.50) MAPTGMNNTP53POLBTHRB
SCHEMBL872484 0.73
SCHEMBL3355353 0.73 TSHR (0.50) MAPTGMNNTP53POLBTHRB
SCHEMBL4427437 0.73
SCHEMBL3348582 0.73 TSHR (0.50) MAPTGMNNTP53POLBTHRB
SCHEMBL3415902 0.73 TSHR (0.50) MAPTGMNNTP53POLBTHRB

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
US-8231969-B2 Asymmetrically functionalized nanoparticles UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 2012-07-31 US disclosed
US-20090256116-A1 Asymmetrically Functionalized NanoParticles UNIVERSITY OF UTAH 2009-10-15 US disclosed