SCHEMBL9056533

SCHEMBL9056533

O=C(C1=Cc2ccccc2Oc2ccccc21)N1CCCCC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RX4 Q99571 1/20 0.47
LMNA P02545 1/20 0.45
DRD2 P14416 3/20 0.45
DRD4 P21917 3/20 0.45
HPGD P15428 4/20 0.44
TSHR P16473 2/20 0.42
RECQL P46063 1/20 0.42
ALDH1A1 P00352 5/20 0.41
GAA P10253 3/20 0.41
NPC1 O15118 3/20 0.41
RAB9A P51151 3/20 0.41
GLA P06280 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
TP53 P04637 2/20 0.41
KDM4E B2RXH2 1/20 0.41
MAPT P10636 1/20 0.41
HTT P42858 1/20 0.41
HSD17B10 Q99714 1/20 0.41
ALPL P05186 1/20 0.40

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
SCHEMBL9055138 0.88 HPGD (0.44) LMNADRD2DRD4HPGDTSHR
SCHEMBL4043208 0.76 LMNA (0.70) P2RX4LMNADRD2DRD4HPGD
SCHEMBL4038858 0.76 LMNA (0.54) P2RX4LMNADRD2DRD4ALDH1A1
Hydrochloric Acid SCHEMBL4045240 0.74 LMNA (0.68) P2RX4LMNADRD2DRD4HPGD
SCHEMBL4213975 0.74 LMNA (0.52) P2RX4LMNADRD2DRD4ALDH1A1
SCHEMBL5953434 0.69 DRD2 (0.47) LMNADRD2DRD4ALDH1A1RAB9A
SCHEMBL10667481 0.68 HPGD (0.44) HPGDTSHRALDH1A1GAANPC1
Hydrochloric Acid SCHEMBL9054931 0.68 DRD2 (0.46) LMNADRD2DRD4ALDH1A1RAB9A
SCHEMBL5953609 0.67 DRD2 (0.48) LMNADRD2DRD4ALDH1A1TP53
SCHEMBL6693464 0.66 LMNA (0.47) LMNADRD2DRD4HPGDTSHR

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-0726265-A1 10-Aminoaliphatyl-dibenz(b,f)oxepins with antineurodegenarative activity CIBA-GEIGY AG (CH) 1996-08-14 EP claimed
EP-0726265-A1 10-Aminoaliphatyl-dibenz(b,f)oxepins with antineurodegenarative activity CIBA-GEIGY AG (CH) 1996-08-14 EP disclosed