SCHEMBL3144019

SCHEMBL3144019

Cc1ncc(OCC2(CN)CC2)cc1-c1cccc(N)c1

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FYN P06241 1/20 0.37
MAP4K4 O95819 5/20 0.36
CHRNB1 P11230 1/20 0.35
CHRNB2 P17787 1/20 0.35
CHRNB4 P30926 1/20 0.35
CHRNA3 P32297 1/20 0.35
CHRNB3 Q05901 1/20 0.35
KIT P10721 3/20 0.34
USP7 Q93009 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
ABL1 P00519 1/20 0.33
MAOA P21397 1/20 0.32
ADRA2A P08913 1/20 0.32
ADRA2B P18089 1/20 0.32
ADRA2C P18825 1/20 0.32

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
Hydrochloric Acid SCHEMBL3768581 0.99 FYN (0.37) FYNMAP4K4CHRNB1CHRNB2CHRNB4
SCHEMBL3155137 0.88 MAP4K4 (0.35) FYNMAP4K4CHRNB1CHRNB2CHRNB4
Hydrochloric Acid SCHEMBL3770439 0.87 MAP4K4 (0.35) FYNMAP4K4CHRNB1CHRNB2CHRNB4
Hydrochloric Acid SCHEMBL3773421 0.86 DHFR (0.36) FYNUSP7
SCHEMBL3154920 0.86 MAP4K4 (0.35) FYNMAP4K4CHRNB4CHRNA3
Hydrochloric Acid SCHEMBL3781375 0.86 ABL1 (0.34) FYNABL1
Hydrochloric Acid SCHEMBL3776437 0.85 MAP4K4 (0.35) FYNMAP4K4CHRNB4CHRNA3
SCHEMBL3137015 0.84 ABL1 (0.37) MAP4K4KITUSP7SMN1; SMN2ABL1
Hydrochloric Acid SCHEMBL3776994 0.82 MAP4K4 (0.38) FYNMAP4K4CHRNB1CHRNB2CHRNB4
SCHEMBL3770703 0.80 SMN1; SMN2 (0.33) USP7SMN1; SMN2ABL1MAOA

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-1979321-B9 NOVEL PYRIDINYLAMINOALKYLENE- AND PYRIDINYLOXYALKYLENE-CYCLOPROPANAMINES, PROCESS FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SERVIER LAB (FR) 2010-02-17 EP disclosed
EP-1979321-B1 NOVEL PYRIDINYLAMINOALKYLENE- AND PYRIDINYLOXYALKYLENE-CYCLOPROPANAMINES, PROCESS FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SERVIER LAB (FR) 2009-07-29 EP disclosed