SCHEMBL8969292

SCHEMBL8969292

CCOC(=O)[C@@H]1COC[C@H]1OC

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPM1B O75688 1/20 0.37
PTPN1 P18031 1/20 0.37
PPP1CC P36873 1/20 0.37
CA1 P00915 6/20 0.35
CA2 P00918 6/20 0.35
CA12 O43570 5/20 0.35
CA9 Q16790 5/20 0.35
TSHR P16473 3/20 0.33
MAPT P10636 1/20 0.33
LMNA P02545 1/20 0.33
POLB P06746 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
SCHEMBL5778032 0.85 PPM1B (0.43) PPM1BPTPN1PPP1CCCA1CA2
SCHEMBL23378605 0.79 CA1 (0.43) PPM1BPTPN1PPP1CCCA1CA2
SCHEMBL5780037 0.78 PPM1B (0.46) PPM1BPTPN1PPP1CCCA1CA2
SCHEMBL24287722 0.78 PPM1B (0.39) PPM1BPTPN1PPP1CCCA1CA2
SCHEMBL8970208 0.78 PPM1B (0.39) PPM1BPTPN1PPP1CCCA1CA2
SCHEMBL419733 0.77 CA1 (0.42) PPM1BPTPN1PPP1CCCA1CA2
SCHEMBL18562238 0.76 PPM1B (0.38) PPM1BPTPN1PPP1CCCA1CA2
SCHEMBL30672673 0.76 PPM1B (0.38) PPM1BPTPN1PPP1CCCA1CA2
SCHEMBL8970222 0.75 GABRR1 (0.31)
SCHEMBL3044399 0.73

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-0376294-B1 Optically active compounds, liquid crystal compositions comprising said compounds, and liquid crystal optical modulators using said compositions HITACHI LTD (JP) 1996-03-13 EP disclosed
US-5370821-A Optically active compounds, liquid crystal compositions comprising said compounds, and liquid crystal optical modulators using said compositions TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1994-12-06 US disclosed
US-5269965-A Optically active compounds, liquid crystal compositions comprising said compounds and liquid crystal optical modulators using said compositions TAKEDA CHEMICAL INDUSTRIES (JP) 1993-12-14 US disclosed
EP-0376294-A1 Optically active compounds, liquid crystal compositions comprising said compounds, and liquid crystal optical modulators using said compositions HITACHI, LTD. (JP) 1990-07-04 EP disclosed