SCHEMBL6421779

SCHEMBL6421779

O=C(O)CCCCCCCCCCCCCCCOOCCCCCCCCCCCCCCCCO

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 7/20 0.73
FFAR1 O14842 2/20 0.73
FFAR4 Q5NUL3 2/20 0.73
CAMK2A Q9UQM7 1/20 0.56
ALDH1A1 P00352 4/20 0.56
TSHR P16473 5/20 0.55
LMNA P02545 3/20 0.55
NFKB1 P19838 1/20 0.55
PMP22 Q01453 1/20 0.55
GAA P10253 1/20 0.46
FNTA P49354 1/20 0.45
FNTB P49356 1/20 0.45
PPARG P37231 6/20 0.44
PPARD Q03181 6/20 0.44
PPARA Q07869 6/20 0.44
HDAC11 Q96DB2 5/20 0.44
TLR2 O60603 2/20 0.44
TDP1 Q9NUW8 2/20 0.44
MEN1 O00255 2/20 0.44
FABP4 P15090 2/20 0.44

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
SCHEMBL30462352 0.91 TSHR (0.67) GPR84FFAR1FFAR4ALDH1A1TSHR
SCHEMBL30965304 0.91 TSHR (0.67) GPR84FFAR1FFAR4ALDH1A1TSHR
SCHEMBL29010718 0.91 TSHR (0.67) GPR84FFAR1FFAR4ALDH1A1TSHR
SCHEMBL9722744 0.91 TSHR (0.67) GPR84FFAR1FFAR4ALDH1A1TSHR
SCHEMBL28881161 0.88 LMNA (0.65) GPR84FFAR1FFAR4ALDH1A1TSHR
SCHEMBL8651891 0.86 GPR84 (0.73) GPR84FFAR1FFAR4CAMK2AALDH1A1
SCHEMBL6551117 0.86 GPR84 (0.73) GPR84FFAR1FFAR4CAMK2AALDH1A1
SCHEMBL7860967 0.86 GPR84 (0.73) GPR84FFAR1FFAR4CAMK2AALDH1A1
SCHEMBL18095273 0.86 GPR84 (0.73) GPR84FFAR1FFAR4CAMK2AALDH1A1
SCHEMBL6697760 0.86 GPR84 (0.73) GPR84FFAR1FFAR4CAMK2AALDH1A1

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-6852686-B2 Methods for ameliorating icthyosiform skin diseases THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2005-02-08 US disclosed
US-20030072795-A1 Methods for ameliorating icthyosiform skin diseases GOVERNMENT OF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES, THE 2003-04-17 US disclosed