SCHEMBL7107860

SCHEMBL7107860

Cc1c(C=CCOC(=O)N(c2ccccc2)c2ccccc2)cccc1OCC(=O)O

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 12/20 0.45
PTGDR Q13258 6/20 0.45
PTGER1 P34995 1/20 0.45
PTGER3 P43115 1/20 0.45
PTGDR2 Q9Y5Y4 1/20 0.44
POLB P06746 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
TRPM8 Q7Z2W7 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.40
GLA P06280 1/20 0.40
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
MEN1 O00255 1/20 0.38
GAA P10253 1/20 0.38
KMT2A Q03164 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
SCHEMBL7109794 1.00 PTGIR (0.45) PTGIRPTGDRPTGER1PTGER3PTGDR2
SCHEMBL7105744 1.00 PTGIR (0.45) PTGIRPTGDRPTGER1PTGER3PTGDR2
SCHEMBL7104410 0.88 DDB1 (0.40) PTGIRPTGDRPTGER1PTGER3POLB
SCHEMBL7107857 0.85 TRPM8 (0.42) PTGIRPTGDRPOLBSMN1; SMN2TRPM8
SCHEMBL7109797 0.85 TRPM8 (0.42) PTGIRPTGDRPOLBSMN1; SMN2TRPM8
SCHEMBL7104175 0.82 MAOB (0.38) PTGIRPTGDRPTGER1PTGER3TRPM8
SCHEMBL7111073 0.78 PTGIR (0.49) PTGIRPTGDRPTGER1PTGER3PTGDR2
SCHEMBL8156825 0.77 L3MBTL1 (0.49) PTGIRPTGDRPTGER1PTGER3PTGDR2
SCHEMBL7105126 0.75 EPOR (0.46) PTGIRPTGDRSMN1; SMN2KDM4EALDH1A1
SCHEMBL7112433 0.75 EPOR (0.46) PTGIRPTGDRSMN1; SMN2KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1013639-B1 Aryl carboxylic acid and tetrazole derivatives comprising a carbamoyloxy unit HOFFMANN LA ROCHE (CH) 2003-10-01 EP claimed
US-6335459-B1 PROSTAGLANDIN I2 RECEPTOR MODULATORS; TREATING TISSUE NECROSIS, PREMATURE UTERINE CONTRACTION, GASTRIC ULCERATION, SEXUAL DYSFUNCTION, MENSTRUAL PAIN AND IMPROPER WOUND HEALING, IMMUNOREGULATION, PLATELET AGGREGATION OR NEUTROPHIL FUNCTION SYNTEX (U.S.A.) LLC 2002-01-01 US claimed
EP-1013639-A1 Aryl carboxylic acid and tetrazole derivatives comprising a carbamoyloxy unit F. HOFFMANN-LA ROCHE AG (CH) 2000-06-28 EP claimed
EP-1013639-B1 Aryl carboxylic acid and tetrazole derivatives comprising a carbamoyloxy unit HOFFMANN LA ROCHE (CH) 2003-10-01 EP disclosed
US-6335459-B1 PROSTAGLANDIN I2 RECEPTOR MODULATORS; TREATING TISSUE NECROSIS, PREMATURE UTERINE CONTRACTION, GASTRIC ULCERATION, SEXUAL DYSFUNCTION, MENSTRUAL PAIN AND IMPROPER WOUND HEALING, IMMUNOREGULATION, PLATELET AGGREGATION OR NEUTROPHIL FUNCTION SYNTEX (U.S.A.) LLC 2002-01-01 US disclosed
EP-1013639-A1 Aryl carboxylic acid and tetrazole derivatives comprising a carbamoyloxy unit F. HOFFMANN-LA ROCHE AG (CH) 2000-06-28 EP disclosed