SCHEMBL9252707

SCHEMBL9252707

CCCCCCCCCCOc1ccc(CBr)c(CBr)c1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ NR5A1 Q13285 1/20 0.51
▸ TSHR P16473 2/20 0.50
▸ CNR2 P34972 2/20 0.47
▸ TP53 P04637 2/20 0.46
▸ LTA4H P09960 2/20 0.46
▸ HTR1B P28222 6/20 0.46
▸ PLA2G4B P0C869 1/20 0.45
▸ HTR1A P08908 5/20 0.45
▸ HTR1D P28221 5/20 0.45
▸ KDM4E B2RXH2 1/20 0.45
▸ CYP1A2 P05177 1/20 0.45
▸ CYP3A4 P08684 1/20 0.45
▸ CYP2D6 P10635 1/20 0.45
▸ MAPT P10636 1/20 0.45
▸ CYP2C9 P11712 1/20 0.45
▸ HTR2A P28223 1/20 0.45
▸ MAPK1 P28482 1/20 0.45
▸ CYP2C19 P33261 1/20 0.45
▸ TDP1 Q9NUW8 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
SCHEMBL7042556 0.87 NR5A1 (0.49) NR5A1TSHRTP53LTA4HHTR1B
SCHEMBL9650728 0.85 THRB (0.49) NR5A1TSHRCNR2TP53LTA4H
SCHEMBL5212753 0.83 KDM4E (0.49) NR5A1TSHRCNR2TP53LTA4H
SCHEMBL14223950 0.79 CNR2 (0.41) NR5A1TSHRCNR2TP53LTA4H
SCHEMBL10642885 0.77 NR5A1 (0.62) NR5A1TSHRTP53LTA4HPLA2G4B
SCHEMBL4945033 0.77 NR5A1 (0.62) NR5A1TSHRTP53LTA4HPLA2G4B
SCHEMBL347683 0.77 NR5A1 (0.62) NR5A1TSHRTP53LTA4HPLA2G4B
SCHEMBL10608846 0.77 L3MBTL1 (0.49) NR5A1TSHRCNR2TP53PLA2G4B
SCHEMBL2829024 0.77 NR5A1 (0.79) NR5A1TSHRTP53LTA4HPLA2G4B
SCHEMBL1573968 0.77 NR5A1 (0.79) NR5A1TSHRTP53LTA4HPLA2G4B

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
US-5432237-A Radically polymerizable composition SHOWA DENKO K.K. (JP) 1995-07-11 — — US disclosed
EP-0399463-B1 Radically polymerizable composition SHOWA DENKO KK (JP) 1994-02-23 — — EP disclosed
EP-0399463-A2 Radically polymerizable composition SHOWA DENKO KABUSHIKI KAISHA (JP) 1990-11-28 — — EP disclosed
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