SCHEMBL11067905

SCHEMBL11067905

C=CCN1C(=O)CCc2cc(Cl)c(OCC(O)CN3CCC(Cc4ccccc4)CC3)cc21

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.58
MEN1 O00255 2/20 0.58
ATM Q13315 1/20 0.58
ALDH1A1 P00352 1/20 0.53
LMNA P02545 1/20 0.53
MAPT P10636 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
ABCB1 P08183 4/20 0.53
DRD4 P21917 6/20 0.51
ADRB2 P07550 2/20 0.50
ADRB1 P08588 2/20 0.50
ADRB3 P13945 2/20 0.50
DRD2 P14416 1/20 0.50
GAA P10253 1/20 0.47

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
SCHEMBL11063923 0.87 KMT2A (0.61) KMT2AMEN1ATMALDH1A1LMNA
SCHEMBL11066890 0.85 ABCB1 (0.57) KMT2AMEN1ATMALDH1A1LMNA
Oxalic Acid SCHEMBL11064628 0.82 ABCB1 (0.57) KMT2AMEN1ATMALDH1A1LMNA
SCHEMBL10580555 0.78 MAPT (0.57) KMT2AMEN1ALDH1A1LMNAMAPT
SCHEMBL11066226 0.77 DRD4 (0.62) KMT2AMEN1ATMDRD4GAA
SCHEMBL11065039 0.76 DRD4 (0.60) KMT2AMEN1ATMABCB1DRD4
SCHEMBL9750911 0.75 KMT2A (0.81) KMT2AMEN1ATMALDH1A1LMNA
Hydrochloric Acid SCHEMBL9751034 0.75 KMT2A (0.80) KMT2AMEN1ATMALDH1A1LMNA
SCHEMBL11072463 0.74 DRD2 (0.46) LMNADRD4ADRB2ADRB1ADRB3
SCHEMBL11066891 0.74 ABCB1 (0.61) KMT2AMEN1ATMABCB1DRD4

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-4482560-A Carbostyril derivatives, and antihistaminic agents containing the same OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1984-11-13 US disclosed