SCHEMBL8065993

SCHEMBL8065993

O=C(O)COc1cccc(C2CCCCC2=Cc2nc(-c3ccccc3)c(-c3ccccc3)o2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FABP4 P15090 3/20 0.50
KDM4E B2RXH2 1/20 0.50
MEN1 O00255 1/20 0.50
ALDH1A1 P00352 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2D6 P10635 1/20 0.50
HPGD P15428 1/20 0.50
KMT2A Q03164 1/20 0.50
HSD17B10 Q99714 1/20 0.50
PTGIR P43119 12/20 0.47
PTGER4 P35408 3/20 0.43
PTGER3 P43115 2/20 0.43
TBXA2R P21731 1/20 0.41
PTGER2 P43116 1/20 0.41
PTGDR Q13258 1/20 0.41
PPARD Q03181 2/20 0.40
PPARA Q07869 1/20 0.40
CPT2 P23786 1/20 0.39
CPT1A P50416 1/20 0.39

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
SCHEMBL8065990 1.00 FABP4 (0.50) FABP4KDM4EMEN1ALDH1A1CYP1A2
SCHEMBL9006849 0.87 NR4A2 (0.42) KDM4EMEN1ALDH1A1CYP1A2CYP3A4
SCHEMBL8066700 0.86 GID4 (0.43) KDM4EMEN1HPGDKMT2APTGIR
SCHEMBL8066704 0.86 GID4 (0.43) KDM4EMEN1HPGDKMT2APTGIR
SCHEMBL9006842 0.85 NR4A2 (0.41) KDM4EMEN1ALDH1A1CYP1A2CYP3A4
SCHEMBL8055417 0.85 PTGIR (0.57) FABP4KDM4EMEN1ALDH1A1CYP1A2
SCHEMBL8055415 0.85 PTGIR (0.57) FABP4KDM4EMEN1ALDH1A1CYP1A2
SCHEMBL9007086 0.76 PTGIR (0.53) FABP4KDM4EMEN1ALDH1A1CYP1A2
SCHEMBL8066927 0.76 PTGIR (0.54) FABP4KDM4EMEN1ALDH1A1CYP1A2
SCHEMBL8065459 0.75 FABP4 (0.56) FABP4KDM4EMEN1ALDH1A1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0736018-B1 4,5-DIARYLOXAZOLE DERIVATIVES FUJISAWA PHARMACEUTICAL CO (JP) 2000-07-05 EP disclosed
US-6025375-A INHIBITORY ACTIVITY ON PLATELET AGGREGATION, VASODILATING ACTIVITY, ANTIHYPERTENSIVE ACTIVITY OR THE LIKE AND ARE PROSTAGLANDIN I.SUB.2 AGONISTS, FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-02-15 US disclosed
WO-1995017393-A1 4,5-DIARYLOXAZOLE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1995-06-29 WO disclosed