SCHEMBL1627201

SCHEMBL1627201

CCOC(=O)C1C2C=CC(O2)C1C(=O)OCC

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PPM1B O75688 4/20 0.49
PTPN1 P18031 2/20 0.49
PPP1CC P36873 1/20 0.49
ALDH1A1 P00352 5/20 0.44
KMT2A Q03164 2/20 0.44
TSHR P16473 2/20 0.43
USP2 O75604 1/20 0.38
HPGD P15428 3/20 0.37
HTT P42858 1/20 0.37
POLB P06746 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
KDM4E B2RXH2 2/20 0.36
HSD17B10 Q99714 2/20 0.36
LMNA P02545 1/20 0.36
MEN1 O00255 1/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35

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
SCHEMBL16675545 0.93 PPM1B (0.56) PPM1BPTPN1PPP1CCALDH1A1KMT2A
SCHEMBL14398354 0.93 PPM1B (0.56) PPM1BPTPN1PPP1CCALDH1A1KMT2A
SCHEMBL15985614 0.84 PPM1B (0.51) PPM1BPTPN1PPP1CCALDH1A1KMT2A
SCHEMBL7715601 0.83 PPM1B (0.40) PPM1BPTPN1PPP1CCALDH1A1KMT2A
SCHEMBL30760499 0.82 PPM1B (0.39) PPM1BPTPN1PPP1CCALDH1A1KMT2A
SCHEMBL13897030 0.79 TSHR (0.38) PPM1BPTPN1PPP1CCALDH1A1KMT2A
SCHEMBL12994228 0.77 ALDH1A1 (0.53) PPM1BPTPN1PPP1CCALDH1A1KMT2A
SCHEMBL13897096 0.76 CHRM1 (0.44) PPM1BPTPN1PPP1CCALDH1A1SMN1; SMN2
SCHEMBL9058122 0.76 CHRM1 (0.44) PPM1BPTPN1PPP1CCALDH1A1SMN1; SMN2
SCHEMBL13897048 0.76 CHRM1 (0.44) PPM1BPTPN1PPP1CCALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7927538-B2 Light-curing slips for the stereolithographic preparation of dental ceramics IVOCLAR VIVADENT AG (LI) 2011-04-19 US disclosed
US-20100029801-A1 LIGHT-CURING SLIPS FOR THE STEREOLITHOGRAPHIC PREPARATION OF DENTAL CERAMICS IVOCLAR VIVADENT AG (LI) 2010-02-04 US disclosed