Sugi Predict

Sugi Predict / Compounds / SCHEMBL9322204

SCHEMBL9322204

SCHEMBL9322204

CCCCCCCCCN(CCCN1CCC(O)CC1)CCC(C)C

nearest known ligand 0.60

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ SPHK1 Q9NYA1 1/20 0.46
▸ GNAO1 P09471 7/20 0.41
▸ GNAI3 P08754 6/20 0.41
▸ GNAI1 P63096 6/20 0.41
▸ GUSB P08236 2/20 0.39
▸ BCHE P06276 3/20 0.38
▸ KCNA3 P22001 1/20 0.38
▸ KCNH2 Q12809 1/20 0.35

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
SCHEMBL9322337 0.92 KCNA3 (0.43) SPHK1KCNA3
SCHEMBL9323544 0.90 KCNA3 (0.40) SPHK1KCNA3
SCHEMBL9322512 0.84 HRH3 (0.40) KCNA3
SCHEMBL9322294 0.84 BCHE (0.50) GNAO1GNAI3GNAI1BCHEKCNH2
SCHEMBL9323669 0.83 HRH3 (0.41) GNAO1GNAI3GNAI1BCHE
SCHEMBL9330369 0.83 HRH3 (0.41) GNAO1GNAI3GNAI1BCHE
SCHEMBL9322732 0.83 HRH3 (0.41) GNAO1GNAI3GNAI1BCHE
SCHEMBL9322139 0.83 HRH3 (0.41) GNAO1GNAI3GNAI1BCHE
SCHEMBL9322325 0.82 KCNA3 (0.41) SPHK1KCNA3
SCHEMBL9322489 0.80 HRH3 (0.46) GNAO1GNAI3GNAI1BCHE

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
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