SCHEMBL9302635

SCHEMBL9302635

CS(=O)(=O)OCCN1COc2ccc(Cl)cc2C1=O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.36
ALPL P05186 3/20 0.35
CYP19A1 P11511 1/20 0.33
BRD4 O60885 1/20 0.32
GABRG2 P18507 3/20 0.32
GABRB3 P28472 3/20 0.32
GABRA5 P31644 3/20 0.32
GABRA1 P14867 2/20 0.32
GABRA3 P34903 2/20 0.32
GABRA2 P47869 2/20 0.32
GABRA6 Q16445 2/20 0.32
POLB P06746 1/20 0.32
GABRA4 P48169 1/20 0.32
LMNA P02545 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
MGAT2 Q10469 1/20 0.31
HTT P42858 2/20 0.31
USP2 O75604 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31

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
SCHEMBL9303640 0.87 KMT2A (0.36) CYP19A1POLBLMNASMN1; SMN2HTT
SCHEMBL9304354 0.85 ALDH1A1 (0.43) CYP19A1POLBSMN1; SMN2ALDH1A1MAPT
SCHEMBL8980658 0.83 PKM (0.37) MAOBALDH1A1PKM
SCHEMBL9173152 0.82 ALDH1A1 (0.39) MAOBGABRG2GABRB3GABRA5GABRA1
SCHEMBL9173014 0.81 MAOB (0.35) MAOBALPLCYP19A1MAPT
SCHEMBL9809787 0.80 MEN1 (0.35) MAOBALPL
SCHEMBL9164262 0.79 MAOB (0.44) MAOBCYP19A1GABRG2GABRB3GABRA5
SCHEMBL8573189 0.78 MAOB (0.40) MAOBALPLCYP19A1HTTUSP2
SCHEMBL9302379 0.76 MAOB (0.36) MAOBLMNASMN1; SMN2HTTUSP2
SCHEMBL9143963 0.76 DRD3 (0.46) MAOBCYP19A1GABRG2GABRB3GABRA5

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-5308844-A ANTIDEPRESSANT, ANXIOLYTIC AGENT, ANALGESIC, HYPOTENSIVE AGENT PIERRE FABRE MEDICAMENT (FR) 1994-05-03 US disclosed