SCHEMBL23200214

SCHEMBL23200214

COc1ccc(NC(=O)N(Cc2ccc(C)o2)C2CCCC2)cc1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 1/20 0.49
ALDH1A1 P00352 3/20 0.48
POLB P06746 3/20 0.48
LMNA P02545 2/20 0.48
USP2 O75604 1/20 0.48
GAA P10253 1/20 0.48
UBE2M P61081 3/20 0.47
DCUN1D1 Q96GG9 3/20 0.47
EPHX2 P34913 1/20 0.46
TP53 P04637 5/20 0.44
MAPT P10636 3/20 0.44
HPGD P15428 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44

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
SCHEMBL23200222 0.88 LMNA (0.51) SLC6A9ALDH1A1LMNAGAAUBE2M
SCHEMBL23200134 0.88 TDP1 (0.53) ALDH1A1POLBLMNAGAAUBE2M
SCHEMBL23200204 0.87 LMNA (0.50) ALDH1A1LMNAGAAUBE2MDCUN1D1
SCHEMBL23200139 0.87 GAA (0.54) SLC6A9ALDH1A1POLBLMNAGAA
SCHEMBL23200154 0.87 LMNA (0.50) ALDH1A1LMNAGAAUBE2MDCUN1D1
SCHEMBL23200048 0.86 ALDH1A1 (0.61) ALDH1A1POLBLMNAUSP2GAA
SCHEMBL23199951 0.86 LMNA (0.53) ALDH1A1LMNAGAAUBE2MDCUN1D1
SCHEMBL23699895 0.85 LMNA (0.56) SLC6A9ALDH1A1POLBLMNAUSP2
SCHEMBL23699911 0.85 GAA (0.55) SLC6A9ALDH1A1LMNAGAAUBE2M
SCHEMBL23200025 0.85 UBE2M (0.60) ALDH1A1POLBLMNAUSP2GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210238139-A1 MODULATORS OF TRYPTOPHAN CATABOLISM E-THERAPEUTICS PLC (GB) 2021-08-05 US claimed
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 SLC6A9 904/4885ALDH1A1 606/4885POLB 2610/4885

“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.