SCHEMBL6265029

SCHEMBL6265029

CCCCCSCC1=CC(C)(C)Nc2ccc(-c3ccccc3)cc21

nearest known ligand 0.62

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ NR3C1 P04150 14/20 0.62
▸ PGR P06401 11/20 0.62
▸ ALDH1A1 P00352 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ CYP2D6 P10635 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ HSD17B10 Q99714 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
SCHEMBL4702715 0.83 PGR (0.74) NR3C1PGRALDH1A1CYP1A2CYP3A4
SCHEMBL4182720 0.81 PGR (0.68) NR3C1PGRALDH1A1HPGD
SCHEMBL4702989 0.81 NR3C1 (0.77) NR3C1PGR
SCHEMBL4184364 0.80 PGR (0.63) NR3C1PGR
SCHEMBL4704933 0.80 NR3C1 (0.79) NR3C1PGR
SCHEMBL4702879 0.78 NR3C1 (0.76) NR3C1PGR
SCHEMBL4702557 0.77 NR3C1 (1.00) NR3C1PGR
SCHEMBL4702588 0.77 NR3C1 (0.74) NR3C1PGR
SCHEMBL27492596 0.76 PGR (0.65) NR3C1PGR
SCHEMBL4705696 0.75 NR3C1 (0.81) NR3C1PGR

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-1532113-A2 SUBSTITUTED HIHYDROQUINOLINES AS GLUCOCORTICOID MIMETICS, METHODS OF MAKING THEM, PHARMACEUTICAL COMPOSITIONS, AND USES THEREOF BOEHRINGER INGELHEIM PHARMACEUTICALS INC. (US) 2005-05-25 — — EP disclosed
WO-2004018429-A2 SUBSTITUTED HIHYDROQUINOLINES AS GLUCOCORTICOID MIMETICS, METHODS OF MAKING THEM, PHARMACEUTICAL COMPOSITIONS, AND USES THEREOF BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2004-03-04 — — WO disclosed
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