SCHEMBL8740485

SCHEMBL8740485

CC(NCc1ccccc1)Oc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 2/20 0.53
CASR P41180 1/20 0.51
POLB P06746 1/20 0.46
BCHE P06276 1/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
MEN1 O00255 4/20 0.43
KMT2A Q03164 4/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
KDM4E B2RXH2 1/20 0.42
CYP3A4 P08684 1/20 0.42
MAPT P10636 1/20 0.42
DRD4 P21917 1/20 0.42
HTT P42858 2/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
MAPK1 P28482 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MTNR1A P48039 1/20 0.41

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
SCHEMBL10775519 0.88 MEN1 (0.51) SIGMAR1POLBBCHENPC1RAB9A
SCHEMBL27941499 0.80 MTNR1A (0.47) SIGMAR1NPC1RAB9AMEN1KMT2A
SCHEMBL19853394 0.80 SIGMAR1 (0.57) SIGMAR1CASRPOLBBCHEMEN1
SCHEMBL5487228 0.79 KMT2A (0.47) SIGMAR1CASRBCHEMEN1KMT2A
SCHEMBL27704266 0.78 SIGMAR1 (0.50) SIGMAR1CASRPOLBBCHEMEN1
Anisole SCHEMBL946396 0.76 CASR (0.62) SIGMAR1CASRNPC1SMN1; SMN2KDM4E
SCHEMBL3413593 0.74 SIGMAR1 (0.65) SIGMAR1CASRPOLBMEN1KMT2A
SCHEMBL22899588 0.74 SIGMAR1 (0.65) SIGMAR1CASRPOLBMEN1KMT2A
SCHEMBL143708 0.74 SIGMAR1 (0.65) SIGMAR1CASRPOLBMEN1KMT2A
SCHEMBL11265712 0.74 MTNR1A (0.54) SIGMAR1CASRBCHENPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5624961-A Benzylaminoethoxybenzene derivatives, production thereof and use thereof JAPAN TOBACCO INC. (JP) 1997-04-29 US claimed
EP-0693474-A1 NOVEL BENZYLAMINOETHOXYBENZENE DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND USE THEREOF Toyo Boseki Kabushiki Kaisha (JP) 1996-01-24 EP claimed
CN-1114644-A Novel benzylaminoethoxybenzene derivatives, production thereof and use thereof TOYO BOSEKI (JP) 1996-01-10 CN claimed
JP-7224013-A None JP disclosed
US-5624961-A Benzylaminoethoxybenzene derivatives, production thereof and use thereof JAPAN TOBACCO INC. (JP) 1997-04-29 US disclosed
US-5624961-A Benzylaminoethoxybenzene derivatives, production thereof and use thereof JAPAN TOBACCO INC. (JP) 1997-04-29 US disclosed
US-5624961-A Benzylaminoethoxybenzene derivatives, production thereof and use thereof JAPAN TOBACCO INC. (JP) 1997-04-29 US disclosed
EP-0693474-A4 NOVEL BENZYLAMINOETHOXYBENZENE DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND USE THEREOF TOYO BOSEKI (JP) 1997-02-05 EP disclosed
EP-0693474-A1 NOVEL BENZYLAMINOETHOXYBENZENE DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND USE THEREOF Toyo Boseki Kabushiki Kaisha (JP) 1996-01-24 EP disclosed
EP-0693474-A1 NOVEL BENZYLAMINOETHOXYBENZENE DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND USE THEREOF Toyo Boseki Kabushiki Kaisha (JP) 1996-01-24 EP disclosed
CN-1114644-A Novel benzylaminoethoxybenzene derivatives, production thereof and use thereof TOYO BOSEKI (JP) 1996-01-10 CN disclosed
CN-1114644-A Novel benzylaminoethoxybenzene derivatives, production thereof and use thereof TOYO BOSEKI (JP) 1996-01-10 CN disclosed
CN-1114644-A Novel benzylaminoethoxybenzene derivatives, production thereof and use thereof TOYO BOSEKI (JP) 1996-01-10 CN disclosed
JP-H07224013-A NEW BENZYLAINOETHOXYBNENZENE DERIVARTIVE TOYOBO CO LTD 1995-08-22 JP disclosed
WO-1995021811-A1 NOVEL BENZYLAMINOETHOXYBENZENE DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND USE THEREOF TOYO BOSEKI KABUSHIKI KAISHA (JP) 1995-08-17 WO disclosed