SCHEMBL6897832

SCHEMBL6897832

CCCCCCCC(O)C1(O)CCCCC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 7/20 0.38
SPHK1 Q9NYA1 2/20 0.38
FFAR1 O14842 2/20 0.38
LMNA P02545 2/20 0.38
CYP2D6 P10635 2/20 0.36
GMNN O75496 1/20 0.36
POLB P06746 1/20 0.36
THPO P40225 1/20 0.36
MTOR P42345 1/20 0.36
BLM P54132 1/20 0.36
KDM4E B2RXH2 1/20 0.36
TP53 P04637 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
MAPT P10636 1/20 0.36
CETP P11597 1/20 0.36
HTT P42858 1/20 0.36
UBE2N P61088 1/20 0.36
SLC6A4 P31645 1/20 0.35
SLC6A3 Q01959 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
SCHEMBL20943424 1.00 GPR84 (0.38) GPR84SPHK1FFAR1LMNACYP2D6
SCHEMBL3267695 0.98 GPR84 (0.39) GPR84SPHK1FFAR1LMNACYP2D6
SCHEMBL566307 0.98 GPR84 (0.35) GPR84SPHK1FFAR1LMNACYP2D6
SCHEMBL15281938 0.92 SLC6A4 (0.33) SLC6A4SLC6A3
SCHEMBL8404976 0.90 FFAR1 (0.41) SPHK1FFAR1LMNAGMNNPOLB
SCHEMBL9315391 0.90 ALDH1A1 (0.32) SLC6A4SLC6A3
SCHEMBL10438740 0.86 ALDH1A1 (0.32)
SCHEMBL9637816 0.84 SLC6A2 (0.32) SLC6A4SLC6A3
SCHEMBL10580169 0.81 ALDH1A1 (0.34) GPR84SPHK1FFAR1
SCHEMBL16156038 0.81 ALDH1A1 (0.34) GPR84SPHK1FFAR1

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
US-6723745-B2 PREVENTION OR TREATMENT OF AUTOIMMUNE DISEASE IN WARM BLOODED ANIMAL SANKYO COMPANY, LIMITED (JP) 2004-04-20 US disclosed