SCHEMBL1940143

SCHEMBL1940143

CC(=O)ON1CCC(N)CC1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GNAI3 P08754 1/20 0.36
GNAO1 P09471 1/20 0.36
GNAI1 P63096 1/20 0.36
CHRM2 P08172 3/20 0.33
MEN1 O00255 1/20 0.33
CYP2D6 P10635 1/20 0.33
KMT2A Q03164 1/20 0.33
CHRM1 P11229 1/20 0.33
HRH2 P25021 1/20 0.31
HRH1 P35367 1/20 0.31
MMP2 P08253 1/20 0.31
ANPEP P15144 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
SCHEMBL28101497 0.88 HRH2 (0.35) GNAI3GNAO1GNAI1CHRM2MEN1
SCHEMBL28112848 0.88 HRH2 (0.35) GNAI3GNAO1GNAI1CHRM2MEN1
SCHEMBL7512749 0.80 GNAI3 (0.33) GNAI3GNAO1GNAI1
SCHEMBL11612677 0.80 ALDH1A1 (0.41) CHRM2MEN1CYP2D6KMT2ACHRM1
SCHEMBL7587454 0.80 CHRM2 (0.34) CHRM2MEN1CYP2D6KMT2ACHRM1
SCHEMBL8483160 0.79 SMN1; SMN2 (0.50) MEN1KMT2ACHRM1
SCHEMBL27637917 0.79 GNAI3 (0.34) GNAI3GNAO1GNAI1CHRM2CHRM1
SCHEMBL31591139 0.78 ALDH1A1 (0.37) CHRM2MEN1CYP2D6KMT2ACHRM1
SCHEMBL29052233 0.78 ALDH1A1 (0.37) CHRM2MEN1CYP2D6KMT2ACHRM1
SCHEMBL7216698 0.78

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116323587-A Small molecules for autoimmune diseases and cancer treatment 阿索斯治疗公司 2023-06-23 CN disclosed
US-20110172126-A1 LIBRARIES OF PEPTIDE CONJUGATES AND METHODS FOR MAKING THEM XENOME LTD (AU) 2011-07-14 US disclosed
EP-2331561-A1 LIBRARIES OF PEPTIDE CONJUGATES AND METHODS FOR MAKING THEM Xenome Ltd (AU) 2011-06-15 EP disclosed
WO-2010025510-A1 LIBRARIES OF PEPTIDE CONJUGATES AND METHODS FOR MAKING THEM XENOME LTD (AU) 2010-03-11 WO disclosed