SCHEMBL19299697

SCHEMBL19299697

CC(C)c1ccc(OCC(=O)NNC(=S)NC(=O)c2cc3ccccc3o2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.63
TDP1 Q9NUW8 2/20 0.63
MAPT P10636 2/20 0.62
KMT2A Q03164 1/20 0.62
L3MBTL1 Q9Y468 1/20 0.62
CYP1A2 P05177 1/20 0.58
CYP2C19 P33261 1/20 0.58
HPGD P15428 1/20 0.58
UBE2N P61088 1/20 0.55
ALDH1A1 P00352 1/20 0.52

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
SCHEMBL19299709 0.83 UBE2N (0.52) POLBTDP1MAPTKMT2AL3MBTL1
SCHEMBL12697080 0.81 KDM4E (0.74) TDP1MAPTKMT2AUBE2NALDH1A1
SCHEMBL19294529 0.81 UBE2N (0.60) TDP1MAPTKMT2AUBE2NALDH1A1
SCHEMBL19294545 0.80 ALDH1A1 (0.57) TDP1MAPTKMT2AUBE2NALDH1A1
SCHEMBL19294528 0.80 MEN1 (0.61) TDP1MAPTKMT2AUBE2NALDH1A1
SCHEMBL19299653 0.79 UBE2N (0.53) TDP1MAPTKMT2AUBE2NALDH1A1
SCHEMBL19299380 0.78 UBE2N (0.55) TDP1MAPTKMT2AHPGDUBE2N
SCHEMBL19299706 0.78 UBE2N (0.55) MAPTKMT2AUBE2NALDH1A1
SCHEMBL19299537 0.78 UBE2N (0.54) TDP1MAPTKMT2AHPGDUBE2N
SCHEMBL19299644 0.78 UBE2N (0.54) TDP1MAPTKMT2AUBE2NALDH1A1

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 POLB 340/4885TDP1 448/4885MAPT 4406/4885
US-20170246139-A1 SYNERGISTIC COMPOSITIONS FOR TREATING MICROBIAL INFECTIONS RNASE1, RNASEL, RNASEH1 POLB 340/4885TDP1 448/4885MAPT 4406/4885

“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.