SCHEMBL24067409

SCHEMBL24067409

CC(C)(C)OC(=O)N1CC(c2nc3ccccc3[nH]2)C1

nearest known ligand 0.59

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR2B P41595 8/20 0.59
USP30 Q70CQ3 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.47
PDE10A Q9Y233 1/20 0.47
POLB P06746 1/20 0.46
MAPT P10636 1/20 0.46
HSD17B10 Q99714 1/20 0.46

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
SCHEMBL742770 0.91 HTR2B (0.50) HTR2BUSP30SMN1; SMN2PDE10APOLB
SCHEMBL762565 0.90 HPGDS (0.57) HTR2BSMN1; SMN2POLB
SCHEMBL19408169 0.90 HPGDS (0.57) HTR2BSMN1; SMN2POLB
SCHEMBL739188 0.90 HPGDS (0.57) HTR2BSMN1; SMN2POLB
SCHEMBL992227 0.88 HTR2B (0.59) HTR2BSMN1; SMN2PDE10APOLBMAPT
SCHEMBL2595653 0.85 BACE1 (0.45) HTR2BMAPT
SCHEMBL26911916 0.85 HPGDS (0.46) HTR2BPDE10A
SCHEMBL21714580 0.84 KMT2A (0.52) HTR2BSMN1; SMN2POLBMAPTHSD17B10
SCHEMBL2590013 0.84 GLA (0.46) HTR2BUSP30SMN1; SMN2MAPT
SCHEMBL20444734 0.84 CHEK2 (0.44) HTR2BUSP30

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
US-20210371992-A1 ELECTROCHEMICAL ORGANIC REACTION SETUP AND METHODS PIRAMAL PHARMA LIMITED (IN) 2021-12-02 US disclosed