SCHEMBL9768495

SCHEMBL9768495

Cn1c(-c2cccnc2)c(CCCCCC(=O)O)c2ccccc21

nearest known ligand 0.76

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 11/20 0.76
CYP11B2 P19099 2/20 0.56
EGFR P00533 2/20 0.52
ALDH1A1 P00352 1/20 0.51
HPGD P15428 1/20 0.51
HSD17B10 Q99714 1/20 0.51
OXER1 Q8TDS5 1/20 0.47
TACR1 P25103 1/20 0.47

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
SCHEMBL10375582 1.00 TBXAS1 (0.76) TBXAS1CYP11B2EGFRALDH1A1HPGD
SCHEMBL10373326 1.00 TBXAS1 (0.76) TBXAS1CYP11B2EGFRALDH1A1HPGD
SCHEMBL10372285 0.89 TBXAS1 (0.61) TBXAS1CYP11B2ALDH1A1HPGDHSD17B10
SCHEMBL10984266 0.88 TBXAS1 (0.60) TBXAS1CYP11B2ALDH1A1HPGDHSD17B10
SCHEMBL10987553 0.87 TBXAS1 (0.60) TBXAS1CYP11B2EGFRALDH1A1HPGD
SCHEMBL9715791 0.87 TBXAS1 (1.00) TBXAS1CYP11B2OXER1TACR1
SCHEMBL10373582 0.86 CYP11B2 (0.61) TBXAS1CYP11B2ALDH1A1HPGDHSD17B10
Hydrochloric Acid SCHEMBL10374265 0.86 TBXAS1 (0.98) TBXAS1CYP11B2OXER1TACR1
SCHEMBL10371976 0.85 TBXAS1 (0.58) TBXAS1CYP11B2EGFRALDH1A1HPGD
SCHEMBL10371978 0.85 TBXAS1 (0.58) TBXAS1CYP11B2EGFRALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0449764-A2 A method of reducing serum uric acid and/or increasing renal uric acid clearance with thromboxane synthetase inhibitor and/or thromboxane receptor antagonist CIBA-GEIGY AG (CH) 1991-10-02 EP claimed
US-5021448-A Method of reducing serum uric acid and/or increasing renal uric acid clearance with thromboxane synthetase inhibitor inhibitor and/or thromboxane receptor antagonist CIBA-GEIGY CORPORATION (US) 1991-06-04 US claimed
EP-0129051-B1 SUBSTITUTED INDOLES CIBA-GEIGY AG (CH) 1990-07-04 EP claimed
US-4511573-A THROMBOXANE SYNTHETASE INHIBITORS CIBA-GEIGY CORPORATION (US) 1985-04-16 US claimed
EP-0129051-A2 Substituted indoles CIBA-GEIGY AG (CH) 1984-12-27 EP claimed
EP-0449764-A2 A method of reducing serum uric acid and/or increasing renal uric acid clearance with thromboxane synthetase inhibitor and/or thromboxane receptor antagonist CIBA-GEIGY AG (CH) 1991-10-02 EP disclosed
US-5021448-A Method of reducing serum uric acid and/or increasing renal uric acid clearance with thromboxane synthetase inhibitor inhibitor and/or thromboxane receptor antagonist CIBA-GEIGY CORPORATION (US) 1991-06-04 US disclosed
EP-0129051-B1 SUBSTITUTED INDOLES CIBA-GEIGY AG (CH) 1990-07-04 EP disclosed
US-4511573-A THROMBOXANE SYNTHETASE INHIBITORS CIBA-GEIGY CORPORATION (US) 1985-04-16 US disclosed
EP-0129051-A2 Substituted indoles CIBA-GEIGY AG (CH) 1984-12-27 EP disclosed