SCHEMBL6863922

SCHEMBL6863922

CCC(CC)C1CCCNC1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CPN1 P15169 2/20 0.44
CPB2 Q96IY4 2/20 0.44
SHBG P04278 1/20 0.38
KCNH2 Q12809 1/20 0.38
SLC6A1 P30531 2/20 0.33
SLC6A11 P48066 1/20 0.33
TSHR P16473 1/20 0.33
LMNA P02545 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
SLC6A13 Q9NSD5 1/20 0.33
APLNR P35414 2/20 0.32
KDM4E B2RXH2 1/20 0.32
MAPT P10636 1/20 0.32
KMT2A Q03164 1/20 0.32
ATM Q13315 1/20 0.32
NOS2 P35228 1/20 0.32
CYP2D6 P10635 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
SCHEMBL13952152 1.00 CPN1 (0.44) CPN1CPB2SHBGKCNH2SLC6A1
SCHEMBL21911259 0.94 SHBG (0.41) CPN1CPB2SHBGKCNH2TSHR
SCHEMBL13259733 0.88 CPN1 (0.40) CPN1CPB2SHBGKCNH2
SCHEMBL23997450 0.86 CPN1 (0.35) CPN1CPB2SHBGKCNH2SMN1; SMN2
SCHEMBL22264537 0.86 KCNH2 (0.40) CPN1CPB2SHBGKCNH2SLC6A1
SCHEMBL22795457 0.85 CPN1 (0.38) CPN1CPB2SHBGKCNH2
SCHEMBL23469236 0.85 CPN1 (0.38) CPN1CPB2SHBGKCNH2
SCHEMBL13285534 0.85 CPN1 (0.38) CPN1CPB2SHBGKCNH2
SCHEMBL26668767 0.84 CPN1 (0.41) CPN1CPB2SHBGKCNH2SLC6A1
SCHEMBL820657 0.83 CPN1 (0.44) CPN1CPB2SHBGKCNH2SLC6A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10914987-B2 Complex and optical element KYOTO UNIVERSITY (JP) 2021-02-09 US disclosed
US-20200241336-A1 COMPLEX AND OPTICAL ELEMENT KYOTO UNIVERSITY (JP) 2020-07-30 US disclosed
CN-101985413-A Onium salt compound KOEI CHEMICAL CO 2011-03-16 CN disclosed
US-6797325-B2 FORMING SOLUTION OF POLYANILINE; POURING SOLUTION ONTO A SUBSTRATE FORMING A MEMBRANE; IMMERSING MEMBRANE IN A NONSOLVENT FOR POLYANILINE, POLYANILINE TO PRECIPITATE FORMING AN PERMEABLE INTEGRALLY SKINNED ASYMMETRIC MEMBRANE THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2004-09-28 US disclosed
CN-1241986-A A process for preparing zeolites using substituted-piperidinium cations CHEVRON USA INC (US) 2000-01-19 CN disclosed