SCHEMBL7838599

SCHEMBL7838599

Cc1cc(Cl)ccc1OCC1CN=C(N)O1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN4A P35499 2/20 0.41
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 1/20 0.40
HIF1A Q16665 1/20 0.40
LMNA P02545 4/20 0.40
SMN1; SMN2 Q16637 4/20 0.40
HPGD P15428 2/20 0.40
HTR1A P08908 1/20 0.40
DRD2 P14416 1/20 0.40
HTR7 P34969 1/20 0.40
HTR6 P50406 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
ALDH1A1 P00352 1/20 0.40
TSHR P16473 2/20 0.39
ESR1 P03372 1/20 0.39
POLB P06746 1/20 0.39
ESR2 Q92731 1/20 0.39
CTDSP1 Q9GZU7 1/20 0.39
TDP1 Q9NUW8 1/20 0.39

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
SCHEMBL7836938 0.86 L3MBTL1 (0.41) LMNASMN1; SMN2HPGDMEN1KMT2A
SCHEMBL3140336 0.83 KDM4E (0.47) CYP1A2HIF1ALMNASMN1; SMN2HPGD
SCHEMBL7837854 0.81 ALDH1A1 (0.58) SCN4AALDH1A1TDP1NPC1
SCHEMBL7828716 0.81 ALDH1A1 (0.58) SCN4AALDH1A1TDP1NPC1
SCHEMBL3135510 0.79 GRM2 (0.50) NPC1
SCHEMBL7828558 0.78 ALDH1A1 (0.43) CYP2C9LMNAHPGDALDH1A1TSHR
SCHEMBL7842308 0.77 TAAR1 (0.57) HIF1ALMNASMN1; SMN2ALDH1A1TSHR
SCHEMBL7836967 0.77 GRM2 (0.54) LMNASMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL7842079 0.76 ALDH1A1 (0.44) SMN1; SMN2MEN1KMT2AALDH1A1TSHR
SCHEMBL11883000 0.75 TAAR1 (0.32) TSHRTAAR1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0710658-B1 5-(Aryloxymethyl)oxazolines, process for their preparation and pharmaceutical compositions containing them ADIR (FR) 2001-10-04 EP disclosed
EP-0710658-A1 5-(Aryloxymethyl)oxazolines, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1996-05-08 EP disclosed