SCHEMBL9845446

SCHEMBL9845446

Nc1ccc2c3c1CCCN3C(=O)CO2

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
HSD17B10 Q99714 1/20 0.35
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
TSHR P16473 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.32
CES1 P23141 2/20 0.32
HTT P42858 1/20 0.32
HTR1A P08908 1/20 0.32
RET P07949 1/20 0.31
ALDH1A1 P00352 2/20 0.30

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
SCHEMBL10910689 0.84 HTR2A (0.37) LMNAL3MBTL1MEN1KMT2ATSHR
SCHEMBL10910976 0.84 MEN1 (0.39) LMNAL3MBTL1HSD17B10MEN1KMT2A
SCHEMBL10997214 0.84 L3MBTL1 (0.33) LMNAL3MBTL1MEN1KMT2ATSHR
SCHEMBL10997207 0.81 LMNA (0.37) LMNAL3MBTL1MEN1KMT2ASMN1; SMN2
SCHEMBL10995658 0.81 LMNA (0.32) LMNAL3MBTL1MEN1KMT2ASMN1; SMN2
SCHEMBL10995825 0.80 KMT2A (0.36) LMNAL3MBTL1MEN1KMT2ATSHR
SCHEMBL10911010 0.79 RAB9A (0.36) LMNAL3MBTL1MEN1KMT2ATSHR
SCHEMBL9845492 0.78
SCHEMBL9845439 0.77 LMNA (0.31) LMNAMEN1KMT2ASMN1; SMN2CES1
SCHEMBL9845452 0.77 MEN1 (0.38) LMNAL3MBTL1HSD17B10MEN1KMT2A

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-0406993-A2 Substituted benzoxazolinone and benzoxazinone derivatives, process for their preparation and their use as agent with herbicide activity SCHERING AKTIENGESELLSCHAFT (DE) 1991-01-09 EP disclosed