SCHEMBL23200060

SCHEMBL23200060

O=C(Nc1ccc(F)c(F)c1)N(Cc1ccco1)C1CCCC1

nearest known ligand 0.67

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
UBE2M P61081 9/20 0.67
DCUN1D1 Q96GG9 9/20 0.67
ALDH1A1 P00352 4/20 0.48
MEN1 O00255 1/20 0.48
USP2 O75604 1/20 0.48
TSHR P16473 1/20 0.48
KMT2A Q03164 1/20 0.48
RAB9A P51151 2/20 0.47
THRB P10828 2/20 0.46
SLC6A9 P48067 1/20 0.44
SLC6A5 Q9Y345 1/20 0.44
MAPK1 P28482 1/20 0.44
NPC1 O15118 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
TP53 P04637 2/20 0.43
MCHR1 Q99705 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
SCHEMBL23699893 0.84 ALDH1A1 (0.63) UBE2MDCUN1D1ALDH1A1MEN1USP2
SCHEMBL23199982 0.82 LMNA (0.55) UBE2MDCUN1D1ALDH1A1RAB9ASLC6A9
SCHEMBL23200018 0.80 ALDH1A1 (0.72) UBE2MDCUN1D1ALDH1A1TSHRSLC6A9
SCHEMBL18658124 0.80 UBE2M (1.00) UBE2MDCUN1D1THRBTP53
SCHEMBL18658204 0.80 UBE2M (0.83) UBE2MDCUN1D1THRBTP53MCHR1
SCHEMBL23200112 0.78 POLB (0.56) UBE2MDCUN1D1ALDH1A1MEN1KMT2A
SCHEMBL23199933 0.77 UBE2M (0.48) UBE2MDCUN1D1ALDH1A1RAB9ASLC6A9
SCHEMBL23200182 0.77 UBE2M (0.49) UBE2MDCUN1D1ALDH1A1RAB9ASLC6A9
SCHEMBL23699928 0.77 DCUN1D1 (0.61) UBE2MDCUN1D1RAB9A
SCHEMBL23199984 0.77 TSHR (0.59) UBE2MDCUN1D1ALDH1A1MEN1TSHR

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 UBE2M 3929/4885DCUN1D1 1039/4885ALDH1A1 606/4885

“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.