SCHEMBL17693449

SCHEMBL17693449

NC(=O)c1nc2ccc(S)cc2[nH]1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PIN1 Q13526 2/20 0.47
CHEK2 O96017 9/20 0.42
PKN1 Q16512 1/20 0.41
PKN2 Q16513 1/20 0.41
HRH4 Q9H3N8 5/20 0.41
EGLN1 Q9GZT9 1/20 0.40
MPO P05164 1/20 0.38
HRH3 Q9Y5N1 1/20 0.38

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
SCHEMBL16268186 0.87 MAPT (0.37) PIN1CHEK2HRH4EGLN1
SCHEMBL28429593 0.85 PIN1 (0.66) PIN1HRH4EGLN1MPOHRH3
SCHEMBL19129660 0.83 PIN1 (0.51) PIN1HRH4EGLN1MPOHRH3
SCHEMBL11211769 0.80 PIN1 (0.73) PIN1CHEK2HRH4
SCHEMBL7152026 0.80 HTR3E (0.57) CHEK2HRH4HRH3
SCHEMBL28845532 0.79 HSP90AA1 (0.62) PIN1CHEK2PKN1PKN2EGLN1
SCHEMBL14690390 0.76 PIN1 (0.76) PIN1CHEK2PKN1PKN2
SCHEMBL7153789 0.76 EGLN1 (0.62) CHEK2EGLN1
SCHEMBL14690446 0.76 HRH4 (0.60) CHEK2HRH4EGLN1
SCHEMBL28918786 0.76 CHEK2 (0.37) PIN1CHEK2PKN1PKN2

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-10442771-B2 Trans-base tunnel reader for sequencing ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2019-10-15 US claimed
US-10442771-B2 Trans-base tunnel reader for sequencing ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2019-10-15 US disclosed
US-20170204066-A1 NANOPORE BASED SEQUENCER ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY 2017-07-20 US disclosed
US-20160108002-A1 UNIVERSAL READER MOLECULE FOR RECOGNITION TUNNELING NATIONAL INSTITUTES OF HEALTH 2016-04-21 US disclosed
US-20160108002-A1 UNIVERSAL READER MOLECULE FOR RECOGNITION TUNNELING NATIONAL INSTITUTES OF HEALTH 2016-04-21 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 (3 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-20160108002-A1 UNIVERSAL READER MOLECULE FOR RECOGNITION TUNNELING TARS2, MTR, BRD4 PIN1 274/4885CHEK2 2337/4885PKN1 3293/4885
US-20170204066-A1 NANOPORE BASED SEQUENCER DNMT3A, DNTT, TELO2 PIN1 860/4885CHEK2 2005/4885PKN1 2151/4885
US-10442771-B2 Trans-base tunnel reader for sequencing DNTT, TRDMT1, TELO2 PIN1 467/4885CHEK2 2385/4885PKN1 2267/4885

“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.