SCHEMBL7516679

SCHEMBL7516679

CC[CH]c1cccc(C(=O)OC)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P4HB P07237 5/20 0.55
GRIN2D O15399 1/20 0.55
GRIN3B O60391 1/20 0.55
GRIN1 Q05586 1/20 0.55
GRIN2A Q12879 1/20 0.55
GRIN2B Q13224 1/20 0.55
GRIN2C Q14957 1/20 0.55
GRIN3A Q8TCU5 1/20 0.55
LOXL2 Q9Y4K0 1/20 0.54
CYP4F2 P78329 2/20 0.53
CYP4A11 Q02928 2/20 0.53
TSHR P16473 1/20 0.50
MEN1 O00255 1/20 0.49
MAPT P10636 1/20 0.49
KMT2A Q03164 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
ALDH1A1 P00352 2/20 0.49
POLB P06746 1/20 0.47
RAB9A P51151 1/20 0.47
SLC7A5 Q01650 1/20 0.47

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
SCHEMBL47068 0.86 ALDH1A1 (0.61) P4HBGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL29677467 0.86 ALDH1A1 (0.61) P4HBGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL14604961 0.85 P4HB (0.58) P4HBGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL9277103 0.85 P4HB (0.51) P4HBGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL27302040 0.85 P4HB (0.58) P4HBGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL8367820 0.84 LOXL2 (0.60) P4HBGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL11456160 0.84 P4HB (0.59) P4HBGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL4407110 0.84 P4HB (0.68) P4HBGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL11222093 0.84 P4HB (0.68) P4HBGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL16618968 0.82 P4HB (0.57) P4HBGRIN2DGRIN3BGRIN1GRIN2A

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-1179529-A1 NOVEL HYDROXAMIC ACID DERIVATIVES Daiichi Fine Chemical Co., Ltd. (JP) 2002-02-13 EP disclosed
EP-1101492-A1 NOVEL REMEDIES FOR ALLERGIC DISEASES FUJI YAKUHIN KOGYO KABUSHIKI KAISHA (JP) 2001-05-23 EP disclosed
EP-1038864-A1 NOVEL METALLOPROTEINASE INHIBITORS FUJI YAKUHIN KOGYO KABUSHIKI KAISHA (JP) 2000-09-27 EP disclosed