SCHEMBL11035448

SCHEMBL11035448

CCOc1cccc2c1C(C)=CC(C)(C)N2

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ NR3C1 P04150 14/20 0.54
▸ ALDH1A1 P00352 3/20 0.50
▸ CYP3A4 P08684 2/20 0.50
▸ HSD17B10 Q99714 2/20 0.50
▸ TDP1 Q9NUW8 2/20 0.50
▸ KDM4E B2RXH2 2/20 0.50
▸ MEN1 O00255 2/20 0.50
▸ HPGD P15428 2/20 0.50
▸ KMT2A Q03164 2/20 0.50
▸ LMNA P02545 1/20 0.50
▸ CYP1A2 P05177 1/20 0.50
▸ CYP2D6 P10635 1/20 0.50
▸ CYP2C9 P11712 1/20 0.50
▸ ALOX15 P16050 1/20 0.50
▸ ALOX12 P18054 1/20 0.50
▸ CYP2C19 P33261 1/20 0.50
▸ HIF1A Q16665 1/20 0.50
▸ PGR P06401 6/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.45

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
SCHEMBL12236645 0.76 NR3C1 (0.52) NR3C1ALDH1A1CYP3A4HSD17B10TDP1
SCHEMBL5040814 0.76 NR3C1 (0.52) NR3C1ALDH1A1CYP3A4HSD17B10TDP1
SCHEMBL940184 0.76 ALDH1A1 (0.50) NR3C1ALDH1A1CYP3A4HSD17B10TDP1
SCHEMBL11653695 0.75 ALDH1A1 (0.56) NR3C1ALDH1A1CYP3A4HSD17B10TDP1
SCHEMBL5034787 0.75 PGR (0.52) NR3C1ALDH1A1CYP3A4HSD17B10TDP1
SCHEMBL12236677 0.75 NR3C1 (0.51) NR3C1PGR
SCHEMBL4174333 0.74 NR3C1 (0.81) NR3C1PGR
SCHEMBL4961012 0.72 ALDH1A1 (0.62) NR3C1ALDH1A1CYP3A4HSD17B10TDP1
SCHEMBL5032342 0.71 PGR (0.46) NR3C1ALDH1A1CYP3A4HSD17B10TDP1
SCHEMBL5034912 0.71 NR3C1 (0.48) NR3C1ALDH1A1CYP3A4HSD17B10TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0147759-A2 Latex containing odor inhibitors The B.F. GOODRICH Company (US) 1985-07-10 — — EP claimed
US-4104196-A Nonabsorbable antioxidant method DYNAPOL (US) 1978-08-01 — — US disclosed
US-3994828-A Nonabsorbable antioxidant DYNAPOL CORPORATION (US) 1976-11-30 — — US disclosed
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