SCHEMBL11287265

SCHEMBL11287265

N[n+]1ccccc1C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.39
TSHR P16473 2/20 0.39
NAPRT Q6XQN6 2/20 0.39
DAO P14920 1/20 0.39
ALOX15 P16050 1/20 0.39
MAPT P10636 2/20 0.36
POLB P06746 1/20 0.36
CYP3A4 P08684 1/20 0.36
PARP1 P09874 1/20 0.36
CYP2C19 P33261 1/20 0.36
RECQL P46063 1/20 0.36
BLM P54132 1/20 0.36
PMP22 Q01453 1/20 0.36
HSD17B10 Q99714 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
CES2 O00748 2/20 0.33
CES1 P23141 2/20 0.33
LMNA P02545 2/20 0.33
MAPK1 P28482 1/20 0.33

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
SCHEMBL7576244 0.82 MAPT (0.41) ALDH1A1TSHRMAPTPOLBCYP3A4
Perchlorate SCHEMBL10912713 0.75 ALDH1A1 (0.43) ALDH1A1TSHRNAPRTDAOMAPT
SCHEMBL14628782 0.74 ALDH1A1 (0.40) ALDH1A1TSHRNAPRTDAOALOX15
SCHEMBL11291960 0.74 MAPT (0.38) ALDH1A1TSHRNAPRTDAOALOX15
SCHEMBL1489277 0.73 KDM4E (0.44) ALDH1A1TSHRNAPRTDAOALOX15
SCHEMBL13113036 0.73 HDAC8 (0.43) ALDH1A1TSHRNAPRTDAOALOX15
SCHEMBL29475148 0.73 KDM4E (0.44) ALDH1A1TSHRNAPRTDAOALOX15
SCHEMBL123490 0.71 ALDH1A1 (0.37) ALDH1A1TSHRNAPRTDAOALOX15
Hydrochloric Acid SCHEMBL11768005 0.71 HDAC8 (0.41) ALDH1A1TSHRNAPRTDAOALOX15
SCHEMBL28317487 0.71 HDAC8 (0.41) ALDH1A1TSHRNAPRTDAOALOX15

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-0059683-A2 7-Acylamido-3-cephem-4-carboxylic acids, process for their preparation, pharmaceutical compositions containing them and their use CIBA-GEIGY AG (CH) 1982-09-08 EP disclosed