SCHEMBL19338256

SCHEMBL19338256

CC(C)S(=O)(=O)C1CCN(CCN)CC1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.41
PRMT3 O60678 1/20 0.36
CARM1 Q86X55 1/20 0.36
PRMT6 Q96LA8 1/20 0.36
PRMT1 Q99873 1/20 0.36
PRMT8 Q9NR22 1/20 0.36
GNAI3 P08754 2/20 0.35
GNAO1 P09471 2/20 0.35
GNAI1 P63096 2/20 0.35
HTR2A P28223 3/20 0.33
KCNH2 Q12809 3/20 0.33
HTR2C P28335 2/20 0.33
POLB P06746 1/20 0.30
HTT P42858 1/20 0.30

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
SCHEMBL18502936 0.79 ALOX15 (0.46) ALOX15PRMT3CARM1PRMT6PRMT1
Hydrochloric Acid SCHEMBL18668753 0.78 ALOX15 (0.44) ALOX15PRMT3CARM1PRMT6PRMT1
SCHEMBL15837580 0.77 HTR2A (0.36) HTR2AHTR2C
SCHEMBL4371445 0.71 ALOX15 (0.50) ALOX15PRMT3CARM1PRMT6PRMT1
SCHEMBL21625313 0.71 HRH3 (0.33) KCNH2
SCHEMBL2600354 0.71
SCHEMBL20715152 0.69 NCF1 (0.31) HTR2AHTR2C
SCHEMBL22922810 0.69 KEAP1 (0.42) ALOX15GNAI3GNAO1GNAI1HTR2A
SCHEMBL7923378 0.68 ALDH1A1 (0.46) PRMT3CARM1PRMT6PRMT1PRMT8
SCHEMBL19267939 0.68 GNAI3 (0.48) ALOX15PRMT3CARM1PRMT6PRMT1

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-2814834-B1 C-3 CYCLOALKENYL TRITERPENOIDS WITH HIV MATURATION INHIBITORY ACTIVITY VIIV HEALTHCARE UK (NO 5) LTD (GB) 2017-09-13 EP disclosed