SCHEMBL7987973

SCHEMBL7987973

CCc1cc[c]c(O)c1CC

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.38
GABRB2 P47870 1/20 0.38
ESR1 P03372 1/20 0.31
ESR2 Q92731 1/20 0.31

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
SCHEMBL9359641 0.86 GABRA1 (0.39) GABRA1GABRB2ESR1ESR2
SCHEMBL9356205 0.83 TYR (0.41) ESR1
SCHEMBL28093477 0.80 TRPA1 (0.32) GABRA1GABRB2ESR1ESR2
SCHEMBL9674011 0.78 NOS3 (0.35)
SCHEMBL9359711 0.78 GABRA1 (0.38) GABRA1GABRB2ESR1ESR2
SCHEMBL125379 0.76 GABRA1 (0.30) GABRA1GABRB2
SCHEMBL458201 0.76 NOS3 (0.32) GABRA1GABRB2
SCHEMBL7989382 0.75 PRKCI (0.33) GABRA1GABRB2
SCHEMBL3422479 0.74 NOS3 (0.31)
SCHEMBL458751 0.74

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6310070-B1 FOR TREATING NEPHRITIS, IMPROVING PROTEINURIA DUE TO GLOMERULONEPHRITIS AND PREVENTING AGGRAVATION OF NEPHRITIS JAPAN ENERGY CORPORATION (JP) 2001-10-30 US disclosed
EP-0999211-A1 NOVEL PURINE DERIVATIVES AND MEDICINAL USE THEREOF JAPAN ENERGY CORPORATION (JP) 2000-05-10 EP disclosed
EP-0457730-B1 Process for preparation of thioderivatives of alkylhydroxyanilinotriazine CIBA GEIGY AG (CH) 1994-11-09 EP disclosed
EP-0324431-B1 NEW INDOLYLPIPERIDINE COMPOUNDS, PROCESSES FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-03-25 EP disclosed
US-5086173-A Hydrogenating in presence of palladium catalyst without isolating the intermediates CIBA-GEIGY CORPORATION (US) 1992-02-04 US disclosed
EP-0457730-A2 Process for preparation of thioderivatives of alkylhydroxyanilinotriazine CIBA-GEIGY AG (CH) 1991-11-21 EP disclosed
US-5017703-A Antiallergens, antiinflammatory FUJISAWA PHARMACEUTICAL COMPANY, LTD. (JP) 1991-05-21 US disclosed
US-4935432-A ANTIALLERGENS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1990-06-19 US disclosed
EP-0324431-A1 New indolylpiperidine compounds, processes for the preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1989-07-19 EP disclosed