SCHEMBL8333352

SCHEMBL8333352

CCOC(=O)C(OC)(C(=O)O)C1CCOCC1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.36
MAPT P10636 2/20 0.35
RECQL P46063 1/20 0.33
ALDH1A1 P00352 4/20 0.33
PPM1B O75688 1/20 0.33
PTPN1 P18031 1/20 0.33
PPP1CC P36873 1/20 0.33
LMNA P02545 2/20 0.32
RAB9A P51151 2/20 0.32
POLB P06746 1/20 0.32
HPGD P15428 1/20 0.32
KMT2A Q03164 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
GAA P10253 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2C19 P33261 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL8333906 0.88 TSHR (0.36) TSHRMAPTRECQLALDH1A1PPM1B
SCHEMBL8329830 0.84 CHRM2 (0.37) MAPTRECQLALDH1A1POLBKMT2A
SCHEMBL8331709 0.77 HRH3 (0.38) TSHRMAPTALDH1A1RAB9AHPGD
SCHEMBL1046841 0.76 TSHR (0.41) TSHRMAPTRECQLALDH1A1PPM1B
SCHEMBL8329827 0.76 ALDH1A1 (0.39) MAPTRECQLALDH1A1POLBKMT2A
SCHEMBL8331831 0.75 TSHR (0.35) TSHRMAPTRECQLALDH1A1PPM1B
SCHEMBL3942273 0.74 TSHR (0.40) TSHRMAPTRECQLALDH1A1PPM1B
SCHEMBL3942274 0.74 TSHR (0.40) TSHRMAPTRECQLALDH1A1PPM1B
SCHEMBL8329692 0.74 HPGD (0.42) TSHRRECQLALDH1A1LMNAHPGD
SCHEMBL8331304 0.73 ALDH1A1 (0.35) MAPTRECQLALDH1A1PPM1BPTPN1

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-5908863-A ANTIGROWTH AGENT FOR BONES DOMPE' S.P.A. (IT) 1999-06-01 US disclosed
EP-0792878-A2 Geminal carboxylic acids and esters thereof, pharmaceutical formulations containing them useful in the treatment of bone dysmetabolism Dompé S.P.A. (IT) 1997-09-03 EP disclosed