SCHEMBL9558262

SCHEMBL9558262

C1CN(C2CCNC2)CCN1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 1/20 0.68
HPGD P15428 1/20 0.40
KMT2A Q03164 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HTR2C P28335 5/20 0.35
HTR2A P28223 2/20 0.35
HTR2B P41595 4/20 0.34
KHK P50053 4/20 0.33
CHRNB2 P17787 1/20 0.32
CHRNA3 P32297 1/20 0.32
CHRNA4 P43681 1/20 0.32
CHRNB3 Q05901 1/20 0.32
CHRNA6 Q15825 1/20 0.32
SLC18A3 Q16572 1/20 0.32
TAAR1 Q96RJ0 1/20 0.32
LMNA P02545 1/20 0.31
CYP3A4 P08684 1/20 0.31
GABRA1 P14867 1/20 0.31
TSHR P16473 1/20 0.31
GABRG2 P18507 1/20 0.31

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
SCHEMBL24684499 0.91 HTR6 (0.70) HTR6HPGDKMT2ASMN1; SMN2HTR2C
SCHEMBL1400723 0.90 HTR6 (0.56) HTR6HPGDKMT2ASMN1; SMN2HTR2C
SCHEMBL514709 0.87
SCHEMBL16556580 0.87
SCHEMBL336575 0.87 HTR6 (0.50) HTR6HPGDKMT2ASMN1; SMN2HTR2C
SCHEMBL1400974 0.87 HTR6 (0.50) HTR6HPGDKMT2ASMN1; SMN2HTR2C
SCHEMBL21094261 0.87 HTR6 (0.53) HTR6HPGDKMT2ASMN1; SMN2HTR2C
SCHEMBL1851727 0.86 HTR6 (0.76) HTR6HPGDKMT2ASMN1; SMN2HTR2C
SCHEMBL12730863 0.85
SCHEMBL238942 0.85 HTR6 (0.75) HTR6HTR2CHTR2BKHKL3MBTL3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9555039-B2 Piperidine derivatives and compositions for the inhibition of nicotinamide phosphoribosyltransferase (NAMPT) FORMA TM, LLC. (US) 2017-01-31 US disclosed
EP-1620098-B1 USE OF OXAZOLIDINONE-QUINOLINE HYBRID ANTIBIOTICS FOR THE TREATMENT OF ANTHRAX AND OTHER INFECTIONS MORPHOCHEM AG KOMB CHEMIE (DE) 2008-06-11 EP disclosed
US-5215967-A AMINOACID DERIVATIVES INHIBITING RENIN MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1993-06-01 US disclosed