SCHEMBL5280109

SCHEMBL5280109

C[C@@H](CC[C@H](C)OS(C)(=O)=O)OS(C)(=O)=O

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.55
USP2 O75604 2/20 0.35
TSHR P16473 2/20 0.35
KDM4E B2RXH2 1/20 0.33
LMNA P02545 1/20 0.33
MMP9 P14780 1/20 0.33
ALOX15 P16050 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33

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
SCHEMBL2858226 1.00 ALDH1A1 (0.55) ALDH1A1USP2TSHRKDM4ELMNA
SCHEMBL2756235 1.00 ALDH1A1 (0.55) ALDH1A1USP2TSHRKDM4ELMNA
SCHEMBL10473440 0.92 ALDH1A1 (0.48) ALDH1A1USP2TSHR
SCHEMBL14779634 0.89 ALDH1A1 (0.50) ALDH1A1USP2TSHRKDM4ELMNA
SCHEMBL2756236 0.89 ALDH1A1 (0.50) ALDH1A1USP2TSHRKDM4ELMNA
SCHEMBL14778728 0.87 ALDH1A1 (0.48) ALDH1A1USP2TSHRKDM4ELMNA
SCHEMBL14780210 0.87 ALDH1A1 (0.48) ALDH1A1USP2TSHRKDM4ELMNA
SCHEMBL31456089 0.87 ALDH1A1 (0.48) ALDH1A1USP2TSHR
SCHEMBL28760408 0.87 ALDH1A1 (0.48) ALDH1A1USP2TSHRCA1CA2
SCHEMBL4446331 0.87 ALDH1A1 (0.48) ALDH1A1USP2TSHRCA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1864990-A1 Preparation of secondary phosphines Universität Wien (AT) 2007-12-12 EP disclosed
EP-1864990-A1 Preparation of secondary phosphines Universität Wien (AT) 2007-12-12 EP disclosed
WO-2007137319-A2 PREPARATION OF SECONDARY PHOSPHINES Universität Wien (AT) 2007-12-06 WO disclosed
EP-0582668-B1 CHIRAL TRIDENTATE BIS(PHOSPHOLANE) LIGANDS DU PONT (US) 1997-11-19 EP disclosed
EP-0528865-B1 CHIRAL PHOSPHOLANE TRANSITION METAL CATALYSTS DU PONT (US) 1995-01-11 EP disclosed
US-5322956-A Enantioselective hydrogenation of unsaturated compounds E. I. DU PONT DE NEMOURS AND COMPANY (US) 1994-06-21 US disclosed
US-5258553-A Chiral tridentate bis(phospholane) ligands E. I. DUPONT DE NEMOURS AND COMPANY (US) 1993-11-02 US disclosed
US-5206398-A For enantioselective hydrogenation E. I. DU PONT DE NEMOURS AND COMPANY (US) 1993-04-27 US disclosed
US-5202493-A CHIRAL TRIDENTATE BIS(PHOSPHOLANE) LIGANDS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1993-04-13 US disclosed
EP-0528865-A1 CHIRAL PHOSPHOLANE TRANSITION METAL CATALYSTS. DU PONT (US) 1993-03-03 EP disclosed
US-5177230-A Chiral phospholane transistor metal catalysts E. I. DU PONT DE NEMOURS AND COMPANY (US) 1993-01-05 US disclosed
WO-1991017998-A1 CHIRAL PHOSPHOLANE TRANSITION METAL CATALYSTS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1991-11-28 WO disclosed
US-5008457-A Enantioselective hydrogenation of unsaturated compounds E. I. DU PONT DE NEMOURS AND COMPANY (US) 1991-04-16 US disclosed