SCHEMBL8103322

SCHEMBL8103322

CCCCCCC(N)CN(Cc1ccccc1)CC(N)CCCCC

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PLA2G1B P04054 1/20 0.57
▸ PLA2G2A P14555 1/20 0.57
▸ CSNK1E P49674 1/20 0.50
▸ KCNH2 Q12809 4/20 0.46
▸ SIGMAR1 Q99720 2/20 0.43
▸ MAPT P10636 1/20 0.42
▸ DPP8 Q6V1X1 1/20 0.40
▸ DPP9 Q86TI2 1/20 0.40
▸ DPP7 Q9UHL4 1/20 0.40

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
SCHEMBL8161936 0.78 CSNK1E (0.71) CSNK1ESIGMAR1
SCHEMBL8420654 0.78 CSNK1E (0.71) CSNK1ESIGMAR1
SCHEMBL1829488 0.78 CSNK1E (0.71) CSNK1ESIGMAR1
SCHEMBL10399079 0.78 CSNK1E (0.71) CSNK1ESIGMAR1
SCHEMBL4878177 0.78 CSNK1E (0.71) CSNK1ESIGMAR1
SCHEMBL873387 0.78 CSNK1E (0.71) CSNK1ESIGMAR1
SCHEMBL11455433 0.78 CSNK1E (0.71) CSNK1ESIGMAR1
SCHEMBL9485679 0.78 KCNH2 (0.66) KCNH2SIGMAR1MAPT
SCHEMBL1262348 0.78 KCNH2 (0.66) KCNH2SIGMAR1MAPT
SCHEMBL9485273 0.78 KCNH2 (0.66) KCNH2SIGMAR1MAPT

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
EP-0973936-A1 COMBINATORIAL LIBRARIES OF PEPTIDOMIMETIC AMINOTHIOETHER ACIDS ELI LILLY AND COMPANY (US) 2000-01-26 — — EP disclosed
WO-1998046786-A1 COMBINATORIAL LIBRARIES OF PEPTIDOMIMETIC AMINOTHIOETHER ACIDS ELI LILLY AND COMPANY (US) 1998-10-22 — — WO disclosed
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