SCHEMBL7159351

SCHEMBL7159351

O=C(c1cc2cc(O)ccc2o1)N1CCC(c2ccccc2)CC1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 7/20 0.56
ALDH1A1 P00352 6/20 0.56
NPC1 O15118 5/20 0.56
HPGD P15428 3/20 0.56
SMN1; SMN2 Q16637 3/20 0.56
POLB P06746 2/20 0.52
MAPT P10636 2/20 0.52
L3MBTL1 Q9Y468 1/20 0.51
HRH4 Q9H3N8 2/20 0.49
FLT3 P36888 1/20 0.49
LMNA P02545 2/20 0.48
SCD5 Q86SK9 1/20 0.47
SPR P35270 1/20 0.47
KDM4E B2RXH2 1/20 0.47
GLA P06280 1/20 0.47
GAA P10253 1/20 0.47
CASP1 P29466 1/20 0.47
BRCA1 P38398 1/20 0.47
CASP7 P55210 1/20 0.47
HSD17B10 Q99714 1/20 0.47

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
SCHEMBL3455401 0.88 ALDH1A1 (0.72) RAB9AALDH1A1NPC1HPGDSMN1; SMN2
SCHEMBL4915910 0.87 RAB9A (0.66) RAB9AALDH1A1NPC1HPGDSMN1; SMN2
SCHEMBL7163069 0.84 GRIN2D (0.62) RAB9AALDH1A1NPC1HPGDSMN1; SMN2
SCHEMBL7169916 0.82 GRIN2B (0.61) RAB9AALDH1A1NPC1HPGDSMN1; SMN2
SCHEMBL28296511 0.78 RAB9A (0.73) RAB9AALDH1A1NPC1HPGDSMN1; SMN2
SCHEMBL7199038 0.78 ALDH1A1 (0.51) RAB9AALDH1A1NPC1HPGDSMN1; SMN2
SCHEMBL28294795 0.77 HRH4 (0.74) RAB9AALDH1A1NPC1HPGDSMN1; SMN2
SCHEMBL4916710 0.76 HRH4 (0.64) RAB9AALDH1A1NPC1HPGDSMN1; SMN2
SCHEMBL7158838 0.74 GRIN2D (0.62) RAB9AALDH1A1NPC1HPGDSMN1; SMN2
SCHEMBL7159377 0.73 GRIN2B (0.64) RAB9AALDH1A1NPC1HPGDSMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1328514-A1 AMIDE DERIVATIVES AS NMDA RECEPTOR ANTAGONISTS RICHTER GEDEON VEGYESZETI GYAR R.T. (HU) 2003-07-23 EP disclosed
WO-2002034718-A1 AMIDE DERIVATIVES AS NMDA RECEPTOR ANTAGONISTS RICHTER GEDEON VEGYESZETI GYAR RT. (HU) 2002-05-02 WO disclosed