SCHEMBL4584744

SCHEMBL4584744

CC=C(CCCCCC)C(OP(O)O)(c1ccc(C(C)(C)C)cc1C(C)(C)C)c1ccc(C(C)(C)C)cc1C(C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 1/20 0.33
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HDAC3 O15379 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC2 Q92769 1/20 0.31
THRA P10827 1/20 0.30
THRB P10828 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
SCHEMBL9844544 0.88 GAA (0.33) THRATHRB
SCHEMBL9844460 0.85 MEN1 (0.32) GHSRMEN1ALDH1A1MAPTKMT2A
SCHEMBL134530 0.85 MEN1 (0.32) GHSRMEN1ALDH1A1MAPTKMT2A
SCHEMBL6058695 0.85 MEN1 (0.32) GHSRMEN1ALDH1A1MAPTKMT2A
SCHEMBL6058552 0.85 MEN1 (0.32) GHSRMEN1ALDH1A1MAPTKMT2A
SCHEMBL6058716 0.85 MEN1 (0.32) GHSRMEN1ALDH1A1MAPTKMT2A
SCHEMBL1578124 0.80 NR5A2 (0.31)
SCHEMBL2873121 0.77 CNR2 (0.36) GHSRHDAC3HDAC1HDAC2
SCHEMBL5691668 0.76 MEN1 (0.32) GHSRMEN1ALDH1A1MAPTKMT2A
SCHEMBL1578101 0.75 CNR2 (0.36) GHSRMEN1ALDH1A1MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0955087-B1 Gas adsorption sheet and air-purifying filter TOYO BOSEKI (JP) 2008-12-24 EP disclosed
US-6746760-B2 Gas adsorption sheet and air-purifying filter TOYOBO CO., LTD (JP) 2004-06-08 US disclosed
US-20030207635-A1 Gas adsorption sheet and air-purifying filter MINEMURA SHINICHI (JP) 2003-11-06 US disclosed
EP-0955087-A1 Gas adsorption sheet and air-purifying filter TOYOBO CO., LTD. (JP) 1999-11-10 EP disclosed