SCHEMBL14428546

SCHEMBL14428546

CCc1cc(O)cc(OC(=O)OC2(C)C3CC4CC(C3)CC2C4)c1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CYP17A1 P05093 2/20 0.40
▸ CYP19A1 P11511 2/20 0.40
▸ PTPN1 P18031 1/20 0.37
▸ PTPN11 Q06124 1/20 0.37
▸ GAA P10253 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ XBP1 P17861 1/20 0.33
▸ HSD11B1 P28845 1/20 0.31
▸ CALM1 P0DP23 1/20 0.31
▸ PTGS2 P35354 1/20 0.30

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
SCHEMBL14428543 0.92 CYP17A1 (0.43) CYP17A1CYP19A1GAAMAPTXBP1
SCHEMBL14428544 0.83 CYP17A1 (0.43) CYP17A1CYP19A1PTPN1PTPN11MAPT
SCHEMBL14428542 0.83 CYP17A1 (0.46) CYP17A1CYP19A1MAPTHSD11B1
SCHEMBL14428539 0.78 GAA (0.36) PTPN1PTPN11GAAMAPTXBP1
SCHEMBL14428570 0.75 CYP19A1 (0.46) CYP17A1CYP19A1GAAMAPTHSD11B1
SCHEMBL2611802 0.74 CYP17A1 (0.42) CYP17A1CYP19A1GAAMAPT
SCHEMBL14428552 0.74 CYP19A1 (0.42) CYP17A1CYP19A1GAAMAPTXBP1
SCHEMBL12714505 0.70 CYP17A1 (0.48) CYP17A1CYP19A1GAAMAPTXBP1
SCHEMBL5880684 0.70 CYP17A1 (0.44) CYP17A1CYP19A1HSD11B1
SCHEMBL14428545 0.68 CYP17A1 (0.49) CYP17A1CYP19A1GAAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070190451-A1 Calixresorcinarene compounds, photoresist base materials, and compositions thereof IDEMITSU KOSAN CO., LTD. (JP) 2007-08-16 — — US disclosed
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