SCHEMBL10700779

SCHEMBL10700779

C=CCCCCCCCCCCOc1ccc(-c2ccc(C(=O)O)cc2)cc1

nearest known ligand 0.80

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.80
L3MBTL1 Q9Y468 1/20 0.80
RARB P10826 5/20 0.67
HTT P42858 3/20 0.66
TP53 P04637 1/20 0.59
TSHR P16473 1/20 0.59
PLA2G4B P0C869 6/20 0.57
POLB P06746 1/20 0.55
APEX1 P27695 1/20 0.55
TDP1 Q9NUW8 1/20 0.55
PKM P14618 1/20 0.53
PLA2G4A P47712 1/20 0.52
MAPT P10636 1/20 0.51

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
SCHEMBL8377630 1.00 ALDH1A1 (0.80) ALDH1A1L3MBTL1RARBHTTTP53
SCHEMBL8606864 1.00 ALDH1A1 (0.80) ALDH1A1L3MBTL1RARBHTTTP53
SCHEMBL9146800 1.00 ALDH1A1 (0.80) ALDH1A1L3MBTL1RARBHTTTP53
SCHEMBL8175158 0.98 ALDH1A1 (0.82) ALDH1A1L3MBTL1RARBHTTTP53
SCHEMBL8379459 0.95 ALDH1A1 (0.88) ALDH1A1L3MBTL1RARBHTTTP53
SCHEMBL9448865 0.95 ALDH1A1 (0.88) ALDH1A1L3MBTL1RARBHTTTP53
SCHEMBL4353031 0.95 ALDH1A1 (0.88) ALDH1A1L3MBTL1RARBHTTTP53
SCHEMBL2622416 0.95 ALDH1A1 (0.88) ALDH1A1L3MBTL1RARBHTTTP53
SCHEMBL13346213 0.95 ALDH1A1 (0.88) ALDH1A1L3MBTL1RARBHTTTP53
SCHEMBL8940429 0.94 ALDH1A1 (0.91) ALDH1A1L3MBTL1RARBHTTTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0274128-A2 Liquid-crystalline polymer IDEMITSU KOSAN COMPANY LIMITED (JP) 1988-07-13 EP disclosed