SCHEMBL29562178

SCHEMBL29562178

N#CN1CCCC1c1nc(-c2cccc(-c3ccccc3)c2)n[nH]1

nearest known ligand 0.63

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ USP30 Q70CQ3 19/20 0.63
▸ CPT2 P23786 1/20 0.50
▸ CPT1A P50416 1/20 0.50

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
SCHEMBL29562461 0.92 USP30 (0.64) USP30CPT2CPT1A
SCHEMBL29562224 0.86 USP30 (0.58) USP30CPT2CPT1A
SCHEMBL29679852 0.84 USP30 (0.59) USP30CPT2CPT1A
SCHEMBL22555639 0.80 USP30 (0.85) USP30
SCHEMBL29562648 0.78 USP30 (0.65) USP30
SCHEMBL19400903 0.77 USP30 (1.00) USP30
SCHEMBL19400902 0.77 USP30 (1.00) USP30
SCHEMBL28592398 0.77 USP30 (0.60) USP30
SCHEMBL29562358 0.76 USP30 (0.69) USP30
SCHEMBL19385283 0.75 USP30 (1.00) USP30

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
EP-3433246-B1 1-CYANO-PYRROLIDINE DERIVATIVES AS DBU INHIBITORS MISSION THERAPEUTICS LTD (GB) 2022-05-04 — — EP disclosed
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