SCHEMBL7737516

SCHEMBL7737516

c1ccc(NCCN2CCN(CCNc3ccccc3)CC2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 3/20 0.58
KDM1A O60341 1/20 0.55
CARM1 Q86X55 2/20 0.54
PRMT6 Q96LA8 2/20 0.54
ALDH1A1 P00352 1/20 0.54
MAPT P10636 1/20 0.54
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
SLC2A1 P11166 2/20 0.49
NPSR1 Q6W5P4 1/20 0.47
DRD3 P35462 3/20 0.47
POLB P06746 1/20 0.47
DPP7 Q9UHL4 1/20 0.47
MAOA P21397 1/20 0.47
MAOB P27338 1/20 0.47
DRD2 P14416 2/20 0.47
DRD1 P21728 1/20 0.47
DRD4 P21917 1/20 0.47
DRD5 P21918 1/20 0.47
L3MBTL1 Q9Y468 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
SCHEMBL4932045 0.92 DPP7 (0.58) HTR7KDM1ACARM1PRMT6ALDH1A1
SCHEMBL8673780 0.90 POLB (0.59) ALDH1A1MAPTMEN1KMT2ANPSR1
Hydrochloric Acid SCHEMBL5753957 0.90 DPP7 (0.56) HTR7KDM1ACARM1PRMT6ALDH1A1
SCHEMBL17654095 0.89 HTR7 (0.74) HTR7DRD2
Hydrochloric Acid SCHEMBL11093613 0.88 POLB (0.58) ALDH1A1MEN1KMT2ADRD3POLB
Hydrochloric Acid SCHEMBL11614221 0.88 DPP7 (0.54) HTR7KDM1ACARM1PRMT6ALDH1A1
SCHEMBL9425536 0.87 KDM1A (0.49) HTR7KDM1ACARM1PRMT6ALDH1A1
SCHEMBL7672095 0.87 SIGMAR1 (0.53) HTR7KDM1ACARM1PRMT6ALDH1A1
SCHEMBL5549334 0.87 MEN1 (0.68) MAPTMEN1KMT2APOLB
SCHEMBL12311335 0.84 ADORA2A (0.50) HTR7KDM1ACARM1PRMT6ALDH1A1

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-6410608-B1 USING AN AMINE CATALYST MIXTURES KAO CORPORATION (JP) 2002-06-25 US disclosed