SCHEMBL24460730

SCHEMBL24460730

CSc1ccc(CN2CCCC(c3ccc(C(F)(F)F)cc3)C2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 1/20 0.52
▸ KDM4E B2RXH2 1/20 0.51
▸ ALDH1A1 P00352 1/20 0.51
▸ PDE2A O00408 1/20 0.49
▸ KMT2A Q03164 2/20 0.48
▸ MEN1 O00255 1/20 0.48
▸ POLB P06746 2/20 0.46
▸ MAPT P10636 1/20 0.46
▸ CHKA P35790 1/20 0.45
▸ CCR2 P41597 1/20 0.44
▸ JAK2 O60674 1/20 0.44
▸ JAK1 P23458 1/20 0.44
▸ JAK3 P52333 1/20 0.44
▸ BCHE P06276 1/20 0.44
▸ ACHE P22303 1/20 0.44
▸ BACE1 P56817 1/20 0.44
▸ DRD2 P14416 1/20 0.43
▸ DRD1 P21728 1/20 0.43
▸ DRD4 P21917 1/20 0.43
▸ DRD5 P21918 1/20 0.43

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
SCHEMBL24460625 0.85 KDM4E (0.56) CNR2KDM4EALDH1A1PDE2AKMT2A
SCHEMBL24460661 0.85 KDM4E (0.56) CNR2KDM4EALDH1A1PDE2AKMT2A
SCHEMBL24460749 0.84 CNR2 (0.70) CNR2KDM4EALDH1A1PDE2AKMT2A
SCHEMBL24460628 0.80 ALDH1A1 (0.52) CNR2KDM4EALDH1A1PDE2APOLB
SCHEMBL24460697 0.79 PDE2A (0.52) CNR2KDM4EALDH1A1PDE2ADRD4
SCHEMBL24460681 0.77 KDM4E (0.62) CNR2KDM4EALDH1A1PDE2APOLB
SCHEMBL24126796 0.76 BCHE (0.63) CNR2KMT2AMEN1BCHEACHE
SCHEMBL13059810 0.75 ALDH1A1 (0.59) KDM4EALDH1A1PDE2APOLBMAPT
SCHEMBL24460624 0.73 GAA (0.58) CNR2KDM4EALDH1A1PDE2AKMT2A
SCHEMBL24460758 0.72 ALDH1A1 (0.59) CNR2ALDH1A1PDE2ACCR2DRD2

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
WO-2022109209-A1 SMALL MOLECULE COMPOUNDS AND COMPOSITIONS TELO THERAPEUTICS, INC. (US) 2022-05-27 — — WO disclosed
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