SCHEMBL8498516

SCHEMBL8498516

CCCCCCCCCc1cc(CCCCCCCCC)cc(OC(=O)Oc2ccccc2C(=O)OCC)c1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PPARA Q07869 7/20 0.46
▸ PPARG P37231 5/20 0.46
▸ TSHR P16473 4/20 0.45
▸ ALDH1A1 P00352 3/20 0.45
▸ LMNA P02545 1/20 0.45
▸ TP53 P04637 1/20 0.43
▸ CYP3A4 P08684 1/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ HSD17B10 Q99714 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ PRSS1 P07477 1/20 0.39
▸ PRSS2 P07478 1/20 0.39
▸ PRSS3 P35030 1/20 0.39

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
SCHEMBL8498207 0.95 TSHR (0.47) PPARAPPARGTSHRALDH1A1LMNA
SCHEMBL5706145 0.90 PTGS2 (0.49) PPARAPPARGTSHRALDH1A1LMNA
SCHEMBL5706112 0.90 PTGS2 (0.49) PPARAPPARGTSHRALDH1A1LMNA
SCHEMBL5705977 0.90 PTGS2 (0.49) PPARAPPARGTSHRALDH1A1LMNA
SCHEMBL5705980 0.90 PTGS2 (0.49) PPARAPPARGTSHRALDH1A1LMNA
SCHEMBL8500704 0.90 SLC6A3 (0.45) PPARAPPARGTSHRALDH1A1LMNA
SCHEMBL5706128 0.85 PTGS2 (0.51) TSHRALDH1A1LMNATP53CYP3A4
SCHEMBL8500732 0.85 SLC6A3 (0.47) ALDH1A1L3MBTL1HSD17B10KDM4EPRSS1
SCHEMBL5706142 0.83 THRA (0.56) PPARAPPARGTSHRALDH1A1LMNA
SCHEMBL5705974 0.83 THRA (0.56) PPARAPPARGTSHRALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0764673-B1 Process for the production of polycarbonate TEIJIN LTD (JP) 1999-11-17 — — EP disclosed
US-5696222-A MELT POLYCONDENSATION OF AN AROMATIC DIHYDROXY COMPOUND AND DIPHENYLCARBONATE, THEN ADDING A SPECIFIC CARBONATE OR CARBOCYCLIC ESTER TO FORM TERMINAL BLOCKED POLYCARBONATE TEIJIN LIMITED (JP) 1997-12-09 — — US disclosed
EP-0764673-A2 Process for the production of polycarbonate TEIJIN LIMITED (JP) 1997-03-26 — — EP disclosed
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