SCHEMBL9322340

SCHEMBL9322340

CC(C)CCC(CCC(C)C)NCCCCCCCCCCN1CCCCC1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 3/20 0.48
FPR3 P25089 1/20 0.43
FPR2 P25090 1/20 0.43
RAD52 P43351 1/20 0.40
SIGMAR1 Q99720 6/20 0.39
MAPT P10636 1/20 0.37
CARM1 Q86X55 1/20 0.36
PRMT6 Q96LA8 1/20 0.36
PRMT8 Q9NR22 1/20 0.36
HRH1 P35367 1/20 0.34
TP53 P04637 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL9322361 1.00 HRH3 (0.48) HRH3FPR3FPR2RAD52SIGMAR1
SCHEMBL9321347 1.00 HRH3 (0.48) HRH3FPR3FPR2RAD52SIGMAR1
SCHEMBL9322390 1.00 HRH3 (0.48) HRH3FPR3FPR2RAD52SIGMAR1
SCHEMBL9322203 1.00 HRH3 (0.48) HRH3FPR3FPR2RAD52SIGMAR1
SCHEMBL9322427 1.00 HRH3 (0.48) HRH3FPR3FPR2RAD52SIGMAR1
SCHEMBL9322455 1.00 HRH3 (0.48) HRH3FPR3FPR2RAD52SIGMAR1
SCHEMBL9322157 0.98 HRH3 (0.45) HRH3FPR3FPR2RAD52SIGMAR1
SCHEMBL9324718 0.98 HRH3 (0.45) HRH3FPR3FPR2RAD52SIGMAR1
SCHEMBL9321403 0.93 HRH3 (0.42) HRH3FPR3FPR2SIGMAR1MAPT
SCHEMBL9322327 0.93 HRH3 (0.42) HRH3FPR3FPR2SIGMAR1MAPT

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-5310902-A Glutamate blockers NIPPON CHEMIPHAR CO., LTD. (JP) 1994-05-10 US disclosed
US-5070196-A GLUTAMATE BLOCKERS NIPPON CHEMIPHAR CO., LTD. (JP) 1991-12-03 US disclosed