SCHEMBL10344388

SCHEMBL10344388

CCCc1c(OCCCCCCC2CC(=O)c3ccc(OCC(=O)O)c(CCC)c3O2)ccc(C(C)=O)c1O

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYSLTR1 Q9Y271 15/20 0.61
CYSLTR2 Q9NS75 14/20 0.61
LMNA P02545 1/20 0.55
CYP1A2 P05177 1/20 0.55
MAPT P10636 1/20 0.55
CYP2C9 P11712 1/20 0.55
NFKB1 P19838 1/20 0.55
PPARG P37231 1/20 0.55
BLM P54132 1/20 0.55
PPARD Q03181 1/20 0.55
PPARA Q07869 1/20 0.55
LTB4R Q15722 2/20 0.52
LTB4R2 Q9NPC1 2/20 0.52
TBXAS1 P24557 1/20 0.49

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
SCHEMBL10731283 0.99 CYSLTR2 (0.59) CYSLTR1CYSLTR2LMNACYP1A2MAPT
SCHEMBL10737074 0.93 CYSLTR1 (0.60) CYSLTR1CYSLTR2LTB4RLTB4R2TBXAS1
SCHEMBL10344115 0.92 PPARG (0.56) CYSLTR1CYSLTR2LMNACYP1A2MAPT
SCHEMBL10344377 0.91 PPARG (0.57) CYSLTR1CYSLTR2LMNACYP1A2MAPT
SCHEMBL10407893 0.89 CYSLTR2 (0.59) CYSLTR1CYSLTR2LMNACYP1A2MAPT
SCHEMBL10342887 0.85 LTB4R (0.66) CYSLTR1CYSLTR2LMNACYP1A2MAPT
SCHEMBL10407657 0.84 PPARG (0.54) CYSLTR1CYSLTR2LMNACYP1A2MAPT
SCHEMBL10838488 0.81 LTB4R (0.56) CYSLTR1CYSLTR2LMNACYP1A2MAPT
SCHEMBL10344114 0.80 CYSLTR2 (0.60) CYSLTR1CYSLTR2LMNACYP1A2MAPT
SCHEMBL9821879 0.79 LTB4R (0.57) CYSLTR1CYSLTR2LTB4RLTB4R2

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
EP-0261254-B1 3,4-DIHYDRO-4-OXO-2H-1-BENZOPYRANYLOXY ALKANOIC ACID DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 1990-02-07 EP disclosed
US-4650812-A ANTIALLERGY HOFFMANN-LA ROCHE INC. (US) 1987-03-17 US disclosed