SCHEMBL460139

SCHEMBL460139

OC(O)N1CCN(c2ccccc2)CC1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 1/20 0.58
ADRA2B P18089 1/20 0.58
ADRA2C P18825 1/20 0.58
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
MAPT P10636 2/20 0.49
TSHR P16473 2/20 0.48
USP2 O75604 1/20 0.48
ALDH1A1 P00352 1/20 0.48
PHGDH O43175 1/20 0.48
MGLL Q99685 1/20 0.48
LMNA P02545 2/20 0.48
CHRNA7 P36544 1/20 0.48
HTR3E A5X5Y0 1/20 0.48
HTR3B O95264 1/20 0.48
ADRB1 P08588 1/20 0.48
HTR3A P46098 1/20 0.48
HTR3D Q70Z44 1/20 0.48
HTR3C Q8WXA8 1/20 0.48
SIGMAR1 Q99720 1/20 0.48

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
SCHEMBL23340098 0.83 ADRA2A (0.54) ADRA2AADRA2BADRA2CMEN1KMT2A
SCHEMBL576814 0.81 LMNA (0.67) MEN1KMT2AMAPTTSHRUSP2
SCHEMBL164538 0.81 LMNA (0.67) MEN1KMT2AMAPTTSHRUSP2
SCHEMBL385012 0.81
SCHEMBL576454 0.81 LMNA (0.67) MEN1KMT2AMAPTTSHRUSP2
SCHEMBL16924853 0.81 LMNA (0.67) MEN1KMT2AMAPTTSHRUSP2
SCHEMBL4624722 0.80 ADRA2A (0.51) ADRA2AADRA2BADRA2CMEN1KMT2A
SCHEMBL4624730 0.80 ADRA2A (0.51) ADRA2AADRA2BADRA2CMEN1KMT2A
SCHEMBL8584033 0.80 ADRA2A (0.51) ADRA2AADRA2BADRA2CMEN1KMT2A
SCHEMBL8584036 0.80 ADRA2A (0.51) ADRA2AADRA2BADRA2CMEN1KMT2A

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
US-8574420-B2 Ultrathin multilayered films for controlled release of anionic reagents WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2013-11-05 US disclosed
US-20120065616-A1 Ultrathin Multilayered Films for Controlled Release of Anionic Reagents NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2012-03-15 US disclosed