SCHEMBL8601031

SCHEMBL8601031

CCCCCCCCOC(=O)Nc1cc(C(=O)O)c(O)c(C(C)(C)C)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSNK2A2 P19784 2/20 0.43
CSNK2A1 P68400 2/20 0.43
RAB9A P51151 6/20 0.42
HPGD P15428 4/20 0.42
LMNA P02545 1/20 0.42
ALDH1A1 P00352 2/20 0.42
GAA P10253 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
EPHX2 P34913 1/20 0.42
NPC1 O15118 5/20 0.41
SMN1; SMN2 Q16637 4/20 0.41
NR5A2 O00482 1/20 0.41
NR5A1 Q13285 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
CASP1 P29466 1/20 0.41
KDM4E B2RXH2 1/20 0.41
MAPT P10636 1/20 0.41
MAPK1 P28482 1/20 0.41

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
SCHEMBL45414 0.90 ALDH1A1 (0.51) RAB9AHPGDLMNAALDH1A1GAA
SCHEMBL11803015 0.90 ALDH1A1 (0.51) RAB9AHPGDLMNAALDH1A1GAA
SCHEMBL10361290 0.85 ALDH1A1 (0.57) RAB9AHPGDLMNAALDH1A1GAA
SCHEMBL10360930 0.83 ALDH1A1 (0.44) RAB9AHPGDLMNAALDH1A1GAA
SCHEMBL27811403 0.82 GAA (0.47) CSNK2A2CSNK2A1RAB9AHPGDLMNA
SCHEMBL10360645 0.81 ALDH1A1 (0.42) RAB9AHPGDLMNAALDH1A1GAA
SCHEMBL10775979 0.80 ALDH1A1 (0.51) RAB9AHPGDLMNAALDH1A1GAA
SCHEMBL9153421 0.80 FAAH (0.48) CSNK2A2CSNK2A1RAB9AHPGDLMNA
SCHEMBL28251281 0.78 NR5A2 (0.40) CSNK2A2CSNK2A1RAB9AHPGDLMNA
SCHEMBL1592303 0.78 KDM4E (0.53) RAB9AHPGDLMNAALDH1A1EPHX2

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-0675002-B1 Heat-sensitive recording material FUJI PHOTO FILM CO LTD (JP) 1998-02-25 EP disclosed
EP-0675002-A1 Heat-sensitive recording material FUJI PHOTO FILM CO., LTD. (JP) 1995-10-04 EP disclosed