SCHEMBL8371908

SCHEMBL8371908

Cc1ccccc1ONCCCc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
SIGMAR1 Q99720 7/20 0.48
HPGD P15428 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
L3MBTL1 Q9Y468 1/20 0.44
POLB P06746 1/20 0.44
DRD2 P14416 2/20 0.42
DRD4 P21917 2/20 0.42
DRD3 P35462 1/20 0.42
HTR2A P28223 1/20 0.42

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
Hydrochloric Acid SCHEMBL10766746 0.98 MEN1 (0.51) MEN1KMT2ASIGMAR1HPGDSMN1; SMN2
SCHEMBL5306298 0.83 HTR2A (0.51) MEN1KMT2ASIGMAR1HPGDHTR2A
SCHEMBL27663951 0.80 SIGMAR1 (0.48) MEN1KMT2ASIGMAR1HPGDL3MBTL1
Hydrochloric Acid SCHEMBL8371863 0.80 MEN1 (0.49) MEN1KMT2ASIGMAR1SMN1; SMN2L3MBTL1
SCHEMBL27672267 0.79 SMN1; SMN2 (0.51) MEN1KMT2AHPGDSMN1; SMN2L3MBTL1
SCHEMBL1045802 0.77 DRD2 (0.58) MEN1KMT2ASIGMAR1HPGDL3MBTL1
SCHEMBL27404290 0.77 DRD2 (0.40) MEN1KMT2ASMN1; SMN2DRD2DRD4
SCHEMBL8972602 0.76 SIGMAR1 (0.44) MEN1KMT2ASIGMAR1HPGDL3MBTL1
SCHEMBL12301156 0.75 DRD2 (0.54) SMN1; SMN2DRD2DRD4DRD3
SCHEMBL31438227 0.74 SIGMAR1 (0.59) MEN1KMT2ASIGMAR1L3MBTL1POLB

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
WO-1999018947-A1 PROCESS TO MAKE CHIRAL COMPOUNDS ELI LILLY AND COMPANY (US) 1999-04-22 WO disclosed