SCHEMBL14016281

SCHEMBL14016281

CC1CC=CC[C@@H]1C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 6/20 0.43
ALDH1A1 P00352 4/20 0.42
TDP1 Q9NUW8 3/20 0.42
KDM4E B2RXH2 1/20 0.42
LMNA P02545 1/20 0.42
SMN1; SMN2 Q16637 3/20 0.40
GAA P10253 2/20 0.40
GRM4 Q14833 1/20 0.40
SHMT2 P34897 1/20 0.40
TSHR P16473 2/20 0.39
HSD17B10 Q99714 1/20 0.39
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
TAAR1 Q96RJ0 1/20 0.37

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
SCHEMBL6914864 1.00 POLB (0.43) POLBALDH1A1TDP1KDM4ELMNA
SCHEMBL264855 1.00 POLB (0.43) POLBALDH1A1TDP1KDM4ELMNA
SCHEMBL2916591 1.00 POLB (0.43) POLBALDH1A1TDP1KDM4ELMNA
SCHEMBL6914871 1.00 POLB (0.43) POLBALDH1A1TDP1KDM4ELMNA
SCHEMBL10146298 1.00 POLB (0.43) POLBALDH1A1TDP1KDM4ELMNA
SCHEMBL11792802 0.84 POLB (0.32) POLBALDH1A1TDP1KDM4EGAA
SCHEMBL10739509 0.83 POLB (0.54) POLBALDH1A1TDP1KDM4ESMN1; SMN2
SCHEMBL60588 0.83 POLB (0.54) POLBALDH1A1TDP1KDM4ESMN1; SMN2
SCHEMBL31737192 0.83 POLB (0.54) POLBALDH1A1TDP1KDM4ESMN1; SMN2
SCHEMBL10739512 0.83 POLB (0.54) POLBALDH1A1TDP1KDM4ESMN1; SMN2

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-1995240-A1 QUINOLONE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF Astellas Pharma Inc. (JP) 2008-11-26 EP disclosed