SCHEMBL8404976

SCHEMBL8404976

CCCCCCCCC=CCCCCC(O)C1(O)CCCCC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.41
FFAR4 Q5NUL3 1/20 0.41
MEN1 O00255 1/20 0.38
CYP3A4 P08684 1/20 0.38
KMT2A Q03164 1/20 0.38
FAAH O00519 2/20 0.38
SPHK2 Q9NRA0 2/20 0.38
SPHK1 Q9NYA1 2/20 0.38
TRPV1 Q8NER1 1/20 0.38
CETP P11597 1/20 0.38
GMNN O75496 1/20 0.38
USP2 O75604 1/20 0.38
LMNA P02545 1/20 0.38
CYP1A2 P05177 1/20 0.38
POLB P06746 1/20 0.38
MAPT P10636 1/20 0.38
CYP2C9 P11712 1/20 0.38
ALOX15 P16050 1/20 0.38
APEX1 P27695 1/20 0.38
CYP2C19 P33261 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
SCHEMBL6897832 0.90 GPR84 (0.38) FFAR1FFAR4CYP3A4SPHK1CETP
SCHEMBL20943424 0.90 GPR84 (0.38) FFAR1FFAR4CYP3A4SPHK1CETP
SCHEMBL566307 0.88 GPR84 (0.35) FFAR1CYP3A4SPHK1CETPGMNN
SCHEMBL3267695 0.88 GPR84 (0.39) FFAR1FFAR4CYP3A4SPHK1CETP
SCHEMBL15281938 0.83 SLC6A4 (0.33)
SCHEMBL9315391 0.81 ALDH1A1 (0.32)
SCHEMBL10438740 0.77 ALDH1A1 (0.32)
SCHEMBL9637816 0.75 SLC6A2 (0.32)
SCHEMBL9349870 0.74 FFAR1 (0.51) FFAR1FFAR4MEN1CYP3A4KMT2A
SCHEMBL10580169 0.73 ALDH1A1 (0.34) FFAR1SPHK1

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-5874097-A ANALYZING AIR SAMPLES NEAR OR IN BUILDINGS FOR THE PRESENCE OF A REPORTER MOLECULE, PREFERABLY NAPHTHALENE, TO INDICATE THE PRESENCE OF A TERMITE NEST BOARD OF SUPERVISORS OF LOUISIANA STATE UNIVERSITY AND AGRICULTURAL AND MECHANICAL COLLEGE (US) 1999-02-23 US disclosed