SCHEMBL19859618

SCHEMBL19859618

CN1CCC[C@@H]1Cn1cnc(C(C)(C)C)c1

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CHRNB2 P17787 2/20 0.39
▸ CHRNB4 P30926 2/20 0.39
▸ CHRNA3 P32297 2/20 0.39
▸ CHRNA4 P43681 2/20 0.39
▸ HRH1 P35367 1/20 0.38
▸ HTR6 P50406 2/20 0.38
▸ CHRNB1 P11230 1/20 0.37
▸ CHRNB3 Q05901 1/20 0.37

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
SCHEMBL19859676 0.87 CHRNB2 (0.36) CHRNB2CHRNB4CHRNA3CHRNA4HTR6
SCHEMBL19859674 0.87 CHRNB2 (0.36) CHRNB2CHRNB4CHRNA3CHRNA4HTR6
SCHEMBL19859897 0.85 CHRNB2 (0.35) CHRNB2CHRNB4CHRNA3CHRNA4HTR6
SCHEMBL19859898 0.85 CHRNB2 (0.35) CHRNB2CHRNB4CHRNA3CHRNA4HTR6
SCHEMBL19859635 0.80 HTR6 (0.36) CHRNB2CHRNB4CHRNA3CHRNA4HTR6
SCHEMBL19859632 0.80 HTR6 (0.36) CHRNB2CHRNB4CHRNA3CHRNA4HTR6
SCHEMBL24936210 0.77 KDM4C (0.39) —
SCHEMBL24936213 0.77 PHF8 (0.42) —
SCHEMBL19859848 0.73 HTR6 (0.35) CHRNB2CHRNB4CHRNA3CHRNA4HTR6
SCHEMBL21085843 0.73 HTR6 (0.35) CHRNB2CHRNB4CHRNA3CHRNA4HTR6

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-3497098-A1 FUMAGILLOL COMPOUNDS AND METHODS OF MAKING AND USING SAME Zafgen, Inc. (US) 2019-06-19 — — EP disclosed
WO-2018031877-A1 FUMAGILLOL COMPOUNDS AND METHODS OF MAKING AND USING SAME ZAFGEN, INC. (US) 2018-02-15 — — WO disclosed
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