SCHEMBL7778259

SCHEMBL7778259

CCCCCCCCOc1ccc(C2C=CC(C(=O)O)(c3ccccc3C(=O)O[C@@H](C)CCCCCC)C=C2)cc1

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.51
PTPN11 Q06124 1/20 0.38
PLK1 P53350 1/20 0.38
TSHR P16473 3/20 0.37
TP53 P04637 1/20 0.37
PLA2G4B P0C869 1/20 0.36
FAAH O00519 6/20 0.36
LMNA P02545 1/20 0.35
RARB P10826 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
SCHEMBL9152938 1.00 ALDH1A1 (0.51) ALDH1A1PTPN11PLK1TSHRTP53
SCHEMBL9615779 1.00 ALDH1A1 (0.51) ALDH1A1PTPN11PLK1TSHRTP53
SCHEMBL7780455 1.00 ALDH1A1 (0.51) ALDH1A1PTPN11PLK1TSHRTP53
SCHEMBL7773614 1.00 ALDH1A1 (0.51) ALDH1A1PTPN11PLK1TSHRTP53
SCHEMBL9155386 0.98 ALDH1A1 (0.48) ALDH1A1PTPN11PLK1TSHRTP53
SCHEMBL9157284 0.98 ALDH1A1 (0.48) ALDH1A1PTPN11PLK1TSHRTP53
SCHEMBL9157438 0.98 ALDH1A1 (0.48) ALDH1A1PTPN11PLK1TSHRTP53
SCHEMBL9155601 0.96 ALDH1A1 (0.46) ALDH1A1PTPN11PLK1TSHRTP53
SCHEMBL9156615 0.96 ALDH1A1 (0.46) ALDH1A1PTPN11PLK1TSHRTP53
SCHEMBL9155967 0.96 ALDH1A1 (0.46) ALDH1A1PTPN11PLK1TSHRTP53

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
EP-0877298-B1 Coated xerographic photographic paper XEROX CORP (US) 2001-08-29 EP disclosed
EP-0877298-A2 Coated xerographic photographic paper Xerox Corporation (US) 1998-11-11 EP disclosed