SCHEMBL28046986

SCHEMBL28046986

CC(C)(C)C(=O)Oc1n[nH]cc1CN

nearest known ligand 0.37

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 12/20 0.37
▸ HTR1D P28221 1/20 0.33
▸ HTR1B P28222 1/20 0.33

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
SCHEMBL27621546 0.84 ELANE (0.37) ELANEHTR1DHTR1B
SCHEMBL28127386 0.83 ELANE (0.36) ELANEHTR1DHTR1B
SCHEMBL27594623 0.81 ELANE (0.35) ELANEHTR1DHTR1B
SCHEMBL27808009 0.78 ELANE (0.39) ELANE
SCHEMBL28825391 0.76 ELANE (0.40) ELANEHTR1DHTR1B
SCHEMBL27621412 0.76 ELANE (0.40) ELANE
SCHEMBL27805740 0.75 ELANE (0.39) ELANE
SCHEMBL27786236 0.71 MAPT (0.43) ELANE
SCHEMBL27805639 0.71 ELANE (0.36) ELANE
SCHEMBL27936280 0.69 ELANE (0.34) ELANE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105307657-A Heteroaryl compounds and uses thereof CELGENE AVILOMICS RES INC 2016-02-03 — — CN disclosed
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