SCHEMBL9308074

SCHEMBL9308074

CCCc1ccc(-c2cccc(OC)c2)cc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.73
SLC13A5 Q86YT5 1/20 0.54
ABL1 P00519 2/20 0.51
ABCB1 P08183 2/20 0.51
BCR P11274 2/20 0.51
HCAR2 Q8TDS4 1/20 0.50
CYP1A1 P04798 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP2E1 P05181 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2C8 P10632 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2A6 P11509 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP4B1 P13584 1/20 0.48
CYP2B6 P20813 1/20 0.48
CYP3A5 P20815 1/20 0.48
CYP2A7 P20853 1/20 0.48
CYP3A7 P24462 1/20 0.48
CYP2F1 P24903 1/20 0.48

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
SCHEMBL14382711 0.88 BACE1 (0.58) MAOBCYP1A1CYP1A2CYP2E1CYP3A4
SCHEMBL13952331 0.86 MAOB (0.68) MAOBSLC13A5ABL1ABCB1BCR
SCHEMBL5552809 0.85 MAOB (1.00) MAOBSLC13A5ABL1ABCB1BCR
SCHEMBL1180343 0.83 ABL1 (0.69) MAOBABL1ABCB1BCRCYP1A1
SCHEMBL5556429 0.82 MAOB (0.78) MAOBSLC13A5ABL1ABCB1BCR
SCHEMBL22858341 0.82 TAAR1 (0.62) MAOBABCB1
SCHEMBL7457421 0.81 MAOB (0.68) MAOB
SCHEMBL12736292 0.81 MAOB (0.68) MAOB
SCHEMBL2604700 0.81 MAOB (0.66) MAOBSLC13A5ABL1ABCB1BCR
SCHEMBL10468492 0.81 MAOB (0.66) MAOBSLC13A5ABL1ABCB1BCR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5354905-A N-alkoxymethyl benzamide derivative and manufacturing method therefor, and manufacturing method for benzamide derivative using this N-alkoxymethyl benzamide derivative YASHIMA CHEMICAL INDUSTRY CO., LTD. (JP) 1994-10-11 US disclosed