SCHEMBL7874129

SCHEMBL7874129

CCNCCOc1ccc(NC(=O)c2ccoc2)cc1OC

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 11/20 0.48
RAB9A P51151 4/20 0.46
NPC1 O15118 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
ALDH1A1 P00352 1/20 0.46
TP53 P04637 1/20 0.46
MAPT P10636 2/20 0.46
GAA P10253 1/20 0.46
CASP1 P29466 1/20 0.46
HTR2C P28335 1/20 0.46
PTK2 Q05397 1/20 0.45
LMNA P02545 1/20 0.44
KCNK3 O14649 1/20 0.44
KCNK9 Q9NPC2 1/20 0.44
FAAH O00519 1/20 0.43

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 SCHEMBL7870771 0.99 MCHR1 (0.48) MCHR1RAB9ANPC1SMN1; SMN2ALDH1A1
SCHEMBL7874007 0.86 MCHR1 (0.49) MCHR1RAB9ANPC1SMN1; SMN2ALDH1A1
Hydrochloric Acid SCHEMBL7868842 0.85 MCHR1 (0.48) MCHR1RAB9ANPC1SMN1; SMN2ALDH1A1
Hydrochloric Acid SCHEMBL7873978 0.81 MAPT (0.48) MCHR1RAB9ANPC1SMN1; SMN2ALDH1A1
SCHEMBL7866997 0.75 MAPT (0.46) MCHR1RAB9ANPC1SMN1; SMN2ALDH1A1
Hydrochloric Acid SCHEMBL7870883 0.74 MAPT (0.45) MCHR1RAB9ANPC1SMN1; SMN2ALDH1A1
Hydrochloric Acid SCHEMBL7870706 0.74 MCHR1 (0.48) MCHR1RAB9ANPC1SMN1; SMN2ALDH1A1
SCHEMBL7869889 0.71 PTK2 (0.43) MCHR1RAB9ANPC1SMN1; SMN2ALDH1A1
Hydrochloric Acid SCHEMBL7862227 0.70 PTK2 (0.43) MCHR1RAB9ANPC1SMN1; SMN2ALDH1A1
SCHEMBL5155178 0.70 HSD17B2 (0.57) RAB9ANPC1SMN1; SMN2ALDH1A1TP53

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
US-6300368-B1 FOR THERAPY OF ATRIAL ARRHYTHMIA MITSUI CHEMICALS, INC. (JP) 2001-10-09 US disclosed
EP-0968999-A1 Anilide derivatives and antiarrhythmic agents containing the same Mitsui Chemicals, Inc. (JP) 2000-01-05 EP disclosed