SCHEMBL19299705

SCHEMBL19299705

CC(C)c1ccc(OCC(=O)NNC(=S)NC(=O)c2ccno2)cc1

nearest known ligand 0.69

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
UBE2N P61088 1/20 0.59
RECQL P46063 1/20 0.52
ALDH1A1 P00352 2/20 0.50
MAPT P10636 2/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
KDM4E B2RXH2 1/20 0.50
LMNA P02545 1/20 0.50
HTT P42858 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
TDP1 Q9NUW8 1/20 0.50

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
SCHEMBL19299703 0.82 UBE2N (0.58) UBE2NRECQLALDH1A1MAPTMEN1
SCHEMBL12697080 0.82 KDM4E (0.74) UBE2NALDH1A1MAPTMEN1KMT2A
SCHEMBL19294529 0.82 UBE2N (0.60) UBE2NALDH1A1MAPTMEN1KMT2A
SCHEMBL19299383 0.81 UBE2N (0.62) UBE2NRECQLALDH1A1MAPTMEN1
SCHEMBL19294528 0.81 MEN1 (0.61) UBE2NALDH1A1MAPTMEN1KMT2A
SCHEMBL19299721 0.80 UBE2N (0.58) UBE2NALDH1A1MAPTMEN1KMT2A
SCHEMBL19299377 0.80 KDM4E (0.61) UBE2NRECQLALDH1A1MAPTMEN1
SCHEMBL19299384 0.78 GAA (0.61) UBE2NRECQLALDH1A1MEN1KMT2A
SCHEMBL19299697 0.78 POLB (0.63) UBE2NALDH1A1MAPTKMT2ATDP1
SCHEMBL19294545 0.78 ALDH1A1 (0.57) UBE2NALDH1A1MAPTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3212183-B1 SYNERGISTIC COMPOSITIONS FOR TREATING MICROBIAL INFECTIONS UNIV ROCHESTER (US) 2019-10-02 EP disclosed
US-10028931-B2 Synergistic compositions for treating microbial infections UNIVERSITY OF ROCHESTER (US) 2018-07-24 US disclosed
US-20170246139-A1 SYNERGISTIC COMPOSITIONS FOR TREATING MICROBIAL INFECTIONS UNIVERSITY OF ROCHESTER (US) 2017-08-31 US 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-10028931-B2 Synergistic compositions for treating microbial infections RNASE1, RNASEL, RNASEH1 UBE2N 2057/4885RECQL 682/4885ALDH1A1 3822/4885
US-20170246139-A1 SYNERGISTIC COMPOSITIONS FOR TREATING MICROBIAL INFECTIONS RNASE1, RNASEL, RNASEH1 UBE2N 2057/4885RECQL 682/4885ALDH1A1 3822/4885

“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.