SCHEMBL7032538

SCHEMBL7032538

CCOc1ccccc1-c1ccc2c(c1)C(C)CC(C)(C)N2

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PGR P06401 5/20 0.49
▸ ALDH1A1 P00352 3/20 0.47
▸ HTT P42858 1/20 0.47
▸ NR3C1 P04150 6/20 0.47
▸ NR3C2 P08235 1/20 0.47
▸ AR P10275 1/20 0.47
▸ PTPRC P08575 1/20 0.45
▸ MEN1 O00255 1/20 0.43
▸ USP2 O75604 1/20 0.43
▸ TP53 P04637 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ DHFR P00374 1/20 0.40
▸ HTR2C P28335 2/20 0.39
▸ HTR2A P28223 1/20 0.39
▸ MAPT P10636 1/20 0.37
▸ GRM2 Q14416 1/20 0.37
▸ PAK4 O96013 1/20 0.36

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
SCHEMBL5272296 0.78 ALDH1A1 (0.55) PGRALDH1A1HTTNR3C1NR3C2
SCHEMBL4175103 0.78 ALDH1A1 (0.57) PGRALDH1A1HTTNR3C1NR3C2
SCHEMBL11417214 0.74 PGR (0.40) PGRALDH1A1HTTNR3C1AR
SCHEMBL8053689 0.74 MAPT (0.41) PGRALDH1A1HTTARMEN1
SCHEMBL11582607 0.71 ALDH1A1 (0.52) PGRALDH1A1HTTNR3C1NR3C2
SCHEMBL11581838 0.71 ALDH1A1 (0.52) PGRALDH1A1HTTNR3C1NR3C2
SCHEMBL12670859 0.71 ALDH1A1 (0.58) PGRALDH1A1HTTNR3C1NR3C2
SCHEMBL4961012 0.71 ALDH1A1 (0.62) PGRALDH1A1NR3C1MEN1KMT2A
SCHEMBL16778351 0.70 ALDH1A1 (0.61) PGRALDH1A1HTTNR3C1NR3C2
SCHEMBL4165537 0.70 ALDH1A1 (0.55) PGRALDH1A1HTTNR3C1NR3C2

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
EP-0930529-B1 Heat-sensitive recording material FUJI PHOTO FILM CO LTD (JP) 2003-02-26 — — EP disclosed
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