SCHEMBL8104861

SCHEMBL8104861

CN(C)CCC[N]N(CCN1CCCC1)NCCCN1CCCC1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 4/20 0.34
CARM1 Q86X55 1/20 0.33
PRMT6 Q96LA8 1/20 0.33
PRMT8 Q9NR22 1/20 0.33
BACE1 P56817 1/20 0.32
SIGMAR1 Q99720 2/20 0.31
LMNA P02545 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
ALOX15 P16050 1/20 0.31
MBTD1 Q05BQ5 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL8104871 0.81 HPGD (0.40) HRH3LMNASMN1; SMN2
SCHEMBL8104651 0.76 HRH3 (0.37) HRH3CARM1PRMT6PRMT8BACE1
SCHEMBL8095285 0.73 HRH3 (0.39) HRH3CARM1PRMT6PRMT8SIGMAR1
SCHEMBL7649942 0.72 HRH3 (0.52) HRH3CARM1PRMT6PRMT8SIGMAR1
SCHEMBL8471267 0.70 HRH3 (0.56) HRH3CARM1PRMT6PRMT8SIGMAR1
SCHEMBL7649376 0.70 HRH3 (0.56) HRH3SIGMAR1SMN1; SMN2ALOX15
SCHEMBL16312397 0.69 HRH3 (0.61) HRH3SIGMAR1SMN1; SMN2ALOX15
SCHEMBL3671614 0.68 SIGMAR1 (0.46) HRH3CARM1PRMT6PRMT8SIGMAR1
SCHEMBL24891390 0.66 HRH3 (0.48) HRH3CARM1PRMT6PRMT8SIGMAR1
SCHEMBL9927903 0.66 HRH3 (0.48) HRH3CARM1PRMT6PRMT8SIGMAR1

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-6015814-A Quinazoline derivative ZENECA LIMITED (GB) 2000-01-18 US claimed
US-6015814-A Quinazoline derivative ZENECA LIMITED (GB) 2000-01-18 US disclosed