SCHEMBL23200022

SCHEMBL23200022

Cc1ccc(CN(C(=O)Nc2ccccc2)C2CC2)o1

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DCUN1D1 Q96GG9 10/20 0.61
UBE2M P61081 9/20 0.61
LMNA P02545 2/20 0.59
ALDH1A1 P00352 2/20 0.54
GAA P10253 1/20 0.48
TP53 P04637 1/20 0.47
GCGR P47871 1/20 0.45
ATM Q13315 1/20 0.45
KDM4E B2RXH2 1/20 0.42
USP2 O75604 1/20 0.42
HPGD P15428 1/20 0.42
CASP1 P29466 1/20 0.42
CASP7 P55210 1/20 0.42
HSD17B10 Q99714 1/20 0.42

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
SCHEMBL23200025 0.96 UBE2M (0.60) DCUN1D1UBE2MLMNAALDH1A1GAA
SCHEMBL23200048 0.95 ALDH1A1 (0.61) DCUN1D1UBE2MLMNAALDH1A1GAA
SCHEMBL23199936 0.89 UBE2M (0.54) DCUN1D1UBE2MLMNAALDH1A1GAA
SCHEMBL23699905 0.86 UBE2M (0.51) DCUN1D1UBE2MLMNAALDH1A1GAA
SCHEMBL23699895 0.84 LMNA (0.56) DCUN1D1UBE2MLMNAALDH1A1GAA
SCHEMBL23699911 0.84 GAA (0.55) DCUN1D1UBE2MLMNAALDH1A1GAA
SCHEMBL23200222 0.84 LMNA (0.51) DCUN1D1UBE2MLMNAALDH1A1GAA
SCHEMBL23200154 0.83 LMNA (0.50) DCUN1D1UBE2MLMNAALDH1A1GAA
SCHEMBL23200139 0.83 GAA (0.54) DCUN1D1UBE2MLMNAALDH1A1GAA
SCHEMBL23200204 0.83 LMNA (0.50) DCUN1D1UBE2MLMNAALDH1A1GAA

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
EP-3802503-A1 UREA DERIVATIVE MODULATORS OF TRYPTOPHAN CATABOLISM E-Therapeutics plc (GB) 2021-04-14 EP claimed
US-20210238139-A1 MODULATORS OF TRYPTOPHAN CATABOLISM E-THERAPEUTICS PLC (GB) 2021-08-05 US disclosed
US-20210238139-A1 MODULATORS OF TRYPTOPHAN CATABOLISM E-THERAPEUTICS PLC (GB) 2021-08-05 US disclosed
EP-3802503-A1 UREA DERIVATIVE MODULATORS OF TRYPTOPHAN CATABOLISM E-Therapeutics plc (GB) 2021-04-14 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 (1 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-20210238139-A1 MODULATORS OF TRYPTOPHAN CATABOLISM TPH1, KYNU, TPH2 DCUN1D1 1039/4885UBE2M 3929/4885LMNA 4541/4885

“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.