SCHEMBL9324674

SCHEMBL9324674

CC(C)CCCCN(CCCN1CCCC1)CCC(C)C

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ HRH3 Q9Y5N1 3/20 0.38
▸ MAPT P10636 1/20 0.35
▸ BACE1 P56817 1/20 0.35
▸ LSS P48449 1/20 0.34
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ SIGMAR1 Q99720 3/20 0.33
▸ SLC6A4 P31645 1/20 0.32
▸ FPR3 P25089 1/20 0.32
▸ FPR2 P25090 1/20 0.32

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
SCHEMBL9322145 0.98 HRH3 (0.41) HRH3MAPTBACE1LSSMEN1
SCHEMBL9322161 0.98 HRH3 (0.41) HRH3MAPTBACE1LSSMEN1
SCHEMBL9322241 0.95 HRH3 (0.45) HRH3MAPTLSSSIGMAR1SLC6A4
SCHEMBL10771016 0.95 HRH3 (0.39) HRH3MAPTBACE1LSSMEN1
SCHEMBL10774584 0.93 HRH3 (0.42) HRH3MAPTBACE1LSSMEN1
SCHEMBL9321363 0.93 HRH3 (0.42) HRH3MAPTBACE1LSSMEN1
SCHEMBL9322345 0.93 HRH3 (0.45) HRH3MAPTBACE1LSSMEN1
SCHEMBL9322383 0.92 SIGMAR1 (0.37) HRH3LSSSIGMAR1SLC6A4
SCHEMBL9324742 0.91 HRH3 (0.48) HRH3MAPTSIGMAR1FPR3FPR2
SCHEMBL9322230 0.90 HRH3 (0.48) HRH3MAPTLSSSIGMAR1SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5310902-A Glutamate blockers NIPPON CHEMIPHAR CO., LTD. (JP) 1994-05-10 — — US disclosed
EP-0235942-B1 Alkylenediamine derivatives NIPPON CHEMIPHAR CO (JP) 1994-03-23 — — EP disclosed
US-5070196-A GLUTAMATE BLOCKERS NIPPON CHEMIPHAR CO., LTD. (JP) 1991-12-03 — — US disclosed
EP-0235942-A1 Alkylenediamine derivatives NIPPON CHEMIPHAR CO., LTD. (JP) 1987-09-09 — — EP disclosed
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