SCHEMBL6415461

SCHEMBL6415461

CCCCCCCCCCCC(=O)CCCCC(C)C(=O)O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACE2 Q9BYF1 1/20 0.67
MAPT P10636 2/20 0.59
KMT2A Q03164 2/20 0.59
FFAR1 O14842 3/20 0.56
FFAR4 Q5NUL3 2/20 0.56
LTA4H P09960 1/20 0.55
FAAH O00519 1/20 0.53
GPR84 Q9NQS5 6/20 0.52
CA1 P00915 2/20 0.52
PPARD Q03181 5/20 0.50
LCK P06239 1/20 0.50
ZDHHC20 Q5W0Z9 1/20 0.50
ZDHHC2 Q9UIJ5 1/20 0.50
HAO1 Q9UJM8 1/20 0.48
PPARG P37231 4/20 0.48
PPARA Q07869 4/20 0.48
TSHR P16473 3/20 0.48
HDAC11 Q96DB2 3/20 0.48
ALDH1A1 P00352 2/20 0.48
TDP1 Q9NUW8 2/20 0.48

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
SCHEMBL8583479 1.00 ACE2 (0.67) ACE2MAPTKMT2AFFAR1FFAR4
SCHEMBL7072060 1.00 ACE2 (0.67) ACE2MAPTKMT2AFFAR1FFAR4
SCHEMBL22190484 0.92 LTA4H (0.62) ACE2MAPTKMT2AFFAR1FFAR4
SCHEMBL5858240 0.90 ACE2 (0.58) ACE2MAPTKMT2AFFAR1FFAR4
SCHEMBL7080552 0.90 ACE2 (0.80) ACE2MAPTFFAR1FFAR4LTA4H
SCHEMBL7146627 0.90 ACE2 (0.80) ACE2MAPTFFAR1FFAR4LTA4H
SCHEMBL194398 0.90 ACE2 (0.80) ACE2MAPTFFAR1FFAR4LTA4H
SCHEMBL277986 0.90 ACE2 (0.80) ACE2MAPTFFAR1FFAR4LTA4H
SCHEMBL22023412 0.90 ACE2 (0.80) ACE2MAPTFFAR1FFAR4LTA4H
SCHEMBL2054033 0.90 ACE2 (0.80) ACE2MAPTFFAR1FFAR4LTA4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1075833-B1 Barrier cream SECR DEFENCE (GB) 2005-04-13 EP claimed