SCHEMBL23280497

SCHEMBL23280497

COC(=O)C1=CN=C(Cl)CC1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 2/20 0.37
LMNA P02545 1/20 0.36
CHRM2 P08172 1/20 0.36
CHRM4 P08173 1/20 0.36
CHRM5 P08912 1/20 0.36
THRB P10828 1/20 0.36
CHRM1 P11229 1/20 0.36
SLC6A3 Q01959 8/20 0.36
NPSR1 Q6W5P4 1/20 0.35
BLM P54132 1/20 0.35
MCOLN3 Q8TDD5 1/20 0.35
SLC6A2 P23975 4/20 0.35
CA12 O43570 2/20 0.33
CA9 Q16790 2/20 0.33
CA2 P00918 1/20 0.33
PTPN1 P18031 1/20 0.33
ABL1 P00519 1/20 0.33
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
TSHR P16473 1/20 0.32

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
SCHEMBL21277825 0.77 LOXL2 (0.40) CHRM3LMNACHRM2CHRM4CHRM5
SCHEMBL10036725 0.72 PTPN1 (0.44) CHRM3LMNACHRM2CHRM4CHRM5
SCHEMBL5906945 0.72 PTPN1 (0.50) CHRM3LMNACHRM2CHRM4CHRM5
SCHEMBL28552163 0.69 LMNA (0.35) CHRM3LMNACHRM2CHRM4CHRM5
SCHEMBL29915685 0.69 CHRM3 (0.41) CHRM3LMNACHRM2CHRM4CHRM5
SCHEMBL2600399 0.67 CHRM3 (0.44) CHRM3LMNACHRM2CHRM4CHRM5
SCHEMBL3664888 0.67 CA12 (0.35) CHRM3LMNACHRM2CHRM4CHRM5
SCHEMBL18851673 0.66 CHRM3 (0.36) CHRM3LMNACHRM2CHRM4CHRM5
SCHEMBL43992 0.66
SCHEMBL12905841 0.65 PTPN1 (0.45) CHRM3LMNACHRM2CHRM4CHRM5

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-3189041-B1 TETRAHYDROISOQUINOLINE DERIVED PRMT5-INHIBITORS CTXT PTY LTD (AU) 2021-04-28 EP disclosed