SCHEMBL5600769

SCHEMBL5600769

O=C1CCC(Nc2ccccc2)C1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 1/20 0.45
CRBN Q96SW2 1/20 0.45
NFKB1 P19838 1/20 0.44
NFKB2 Q00653 1/20 0.44
RELA Q04206 1/20 0.44
CARM1 Q86X55 1/20 0.38
PRMT6 Q96LA8 1/20 0.38
SMN1; SMN2 Q16637 4/20 0.37
CA1 P00915 1/20 0.37
ALDH1A1 P00352 3/20 0.37
MAPT P10636 3/20 0.37
GFER P55789 2/20 0.37
MEN1 O00255 1/20 0.37
LMNA P02545 1/20 0.37
PKM P14618 1/20 0.37
ALOX15 P16050 1/20 0.37
ALOX12 P18054 1/20 0.37
RAD52 P43351 1/20 0.37
KMT2A Q03164 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL30675273 1.00 DDB1 (0.45) DDB1CRBNNFKB1NFKB2RELA
SCHEMBL3668555 0.89 DDB1 (0.42) DDB1CRBNNFKB1NFKB2RELA
SCHEMBL7572544 0.88 DDB1 (0.47) DDB1CRBNNFKB1NFKB2RELA
Hydrochloric Acid SCHEMBL6999487 0.86 DDB1 (0.46) DDB1CRBNNFKB1NFKB2RELA
SCHEMBL4043115 0.77 GRIN2B (0.57) CA1
Hydrochloric Acid SCHEMBL4053518 0.76 GRIN2B (0.56) CA1
SCHEMBL236978 0.74 CARM1 (0.52) DDB1CRBNNFKB1NFKB2RELA
SCHEMBL3696096 0.74 CARM1 (0.52) DDB1CRBNNFKB1NFKB2RELA
SCHEMBL7723868 0.73 GRIN2B (0.66) MEN1KMT2ARAB9A
Hydrochloric Acid SCHEMBL1170216 0.72 CARM1 (0.50) DDB1CRBNNFKB1NFKB2RELA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230373919-A1 AT2R ANTAGONISTS AND USES THEREOF ELI LILLY AND COMPANY 2023-11-23 US disclosed
US-20230373919-A1 AT2R ANTAGONISTS AND USES THEREOF ELI LILLY AND COMPANY 2023-11-23 US disclosed
WO-2023224853-A1 AT2R ANTAGONISTS AND USES THEREOF ELI LILLY AND COMPANY (US) 2023-11-23 WO disclosed
EP-1537066-B1 CYCLOPENTENONE DERIVATIVES AS POTENT ACTIVATORS OF HSF-1 BIOGEM S C AR L (IT) 2017-01-25 EP disclosed
US-7183440-B2 Pharmaceutically useful compounds CHARTERHOUSE THERAPEUTICS LTD (GB) 2007-02-27 US disclosed
US-20060040869-A1 Pharmaceutically useful compounds BIOGEM S.C.A.R.L. (IT) 2006-02-23 US disclosed
EP-1537066-A2 IMPROVEMENTS IN PHARMACEUTICALLY USEFUL COMPOUNDS Charterhouse Therapeutics Ltd. (GB) 2005-06-08 EP disclosed
WO-2004013077-A2 CYCLOPENTANONE AND CYCLOPENTANONE DERIVATIVES AS POTENT ACTIVATORS OF HSF-1 CHARTERHOUSE THERAPEUTICS LTD (GB) 2004-02-12 WO disclosed
EP-0214009-A2 Enaminones as potential prodrugs of primary and secondary amines MERCK & CO. INC. (US) 1987-03-11 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060040869-A1 Pharmaceutically useful compounds MC2R, CRKL, NPY2R DDB1 4665/4885CRBN 155/4885NFKB1 2975/4885
US-20230373919-A1 AT2R ANTAGONISTS AND USES THEREOF AGTR2, AGTR1, AVPR2 DDB1 4531/4885CRBN 4685/4885NFKB1 2206/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.