SCHEMBL15313276

SCHEMBL15313276

O=C(O)c1c2cc(C3CC3)c([N+](=O)[O-])cc2nn1-c1ccc(Cl)cc1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
CHEK1 O14757 1/20 0.39
AURKA O14965 1/20 0.39
CSNK1A1 P48729 1/20 0.39
CDK8 P49336 1/20 0.39
NEK2 P51955 1/20 0.39
LIMK1 P53667 1/20 0.39
CDK5 Q00535 1/20 0.39
DYRK1A Q13627 1/20 0.39
CLK4 Q9HAZ1 1/20 0.39
PKM P14618 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
RPA1 P27694 1/20 0.36
PPARA Q07869 1/20 0.35

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
SCHEMBL9105334 0.90 CHEK1 (0.39) CHEK1AURKACSNK1A1CDK8NEK2
SCHEMBL4943018 0.90 CHEK1 (0.39) CHEK1AURKACSNK1A1CDK8NEK2
SCHEMBL9108371 0.88
SCHEMBL15313204 0.81 VCAM1 (0.36) MEN1KMT2APKMSMN1; SMN2
SCHEMBL9108861 0.78
SCHEMBL2720819 0.72 CHEK1 (0.42) MEN1KMT2ACHEK1AURKACSNK1A1
SCHEMBL9108850 0.71
SCHEMBL2724848 0.71 KDM1A (0.32)
SCHEMBL15312915 0.68
SCHEMBL4942592 0.66

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-9447080-B2 Viral polymerase inhibitors BIOTA SCIENTIFIC MANAGEMENT PTY LTD. (AU) 2016-09-20 US disclosed
US-9120775-B2 Viral polymerase inhibitors BIOTA SCIENTIFIC MANAGEMENT PTY LTD (AU) 2015-09-01 US disclosed
US-20150065445-A1 Viral Polymerase Inhibitors BIOTA SCIENTIFIC MANAGEMENT PTY LTD. (AU) 2015-03-05 US disclosed
WO-2013152391-A1 VIRAL POLYMERASE INHIBITORS BIOTA SCIENTIFIC MANAGEMENT PTY LTD (AU) 2013-10-17 WO disclosed
US-20130274218-A1 VIRAL POLYMERASE INHIBITORS BIOTA SCIENTIFIC MANAGEMENT PTY LTD (AU) 2013-10-17 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-20150065445-A1 Viral Polymerase Inhibitors POLR2E, POLM, POLR2H MEN1 4869/4885KMT2A 4465/4885CHEK1 3417/4885
US-20130274218-A1 VIRAL POLYMERASE INHIBITORS POLR2E, POLM, POLR2H MEN1 4869/4885KMT2A 4465/4885CHEK1 3417/4885

“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.