SCHEMBL1032613

SCHEMBL1032613

CCCCC(CC)(CO)C(OP(O)O)c1c(C(C)(C)C)cc(C)cc1C(C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.30
CA2 P00918 1/20 0.30
POLB P06746 1/20 0.30
TYR P14679 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL496750 0.91 NR5A2 (0.32)
SCHEMBL1032616 0.81 SMN1; SMN2 (0.33) ALDH1A1CA2POLBTYRSMN1; SMN2
SCHEMBL3996868 0.80 SMN1; SMN2 (0.33) ALDH1A1CA2POLBTYRSMN1; SMN2
SCHEMBL6224852 0.78 CYP1A2 (0.30)
SCHEMBL2319289 0.77
SCHEMBL1032615 0.76 ALDH1A1 (0.30) ALDH1A1CA2POLBTYRSMN1; SMN2
SCHEMBL5959007 0.76 S1PR1 (0.31)
SCHEMBL995780 0.73 CNR2 (0.36) ALDH1A1CA2POLBTYRSMN1; SMN2
SCHEMBL997156 0.73 CNR2 (0.36) ALDH1A1CA2POLBTYRSMN1; SMN2
SCHEMBL768987 0.72 NR5A2 (0.36)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1160273-B1 POROUS RESIN FILM YUPO CORP (JP) 2011-01-19 EP disclosed
US-6911253-B2 Porous resin film YUPO CORPORATION (JP) 2005-06-28 US disclosed
EP-0926189-B1 A macromolecular material composition and a modifier for macromolecular material HITACHI CHEMICAL CO LTD (JP) 2004-04-14 EP disclosed
US-20020012786-A1 Blend of thermoplastic resin and fine powder; ink jet recording YUPO CORPORATION (JP) 2002-01-31 US disclosed
EP-1160273-A1 POROUS RESIN FILM Yupo Corporation (JP) 2001-12-05 EP disclosed
US-6103828-A A BLENDS COMPRISING THERMOPLASTIC RESINS, THERMOSETTING RESINS AND RUBBERS, AND A POLYVINYL CYCLOHEXANE RESIN OR ACOMPOUND HAVING HYDROINDANE AS VISCOSITY MODIFIER; IMPROVES MELT FLOW, FLEXIBILITY AT A LOW TEMPERATURE, BENDING STRENGTH HITACHI CHEMICAL CO. LTD. (JP) 2000-08-15 US disclosed
EP-0926189-A2 A macromolecular material composition and a modifier for macromolecular material HITACHI CHEMICAL CO., LTD. (JP) 1999-06-30 EP disclosed