SCHEMBL4451535

SCHEMBL4451535

CCCCCCN(C)c1nc(N)nc(N)n1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 3/20 0.41
LMNA P02545 1/20 0.36
PKM P14618 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
GPR84 Q9NQS5 2/20 0.36
TLR8 Q9NR97 3/20 0.35
TLR7 Q9NYK1 2/20 0.35
PTPN11 Q06124 1/20 0.35
EHMT2 Q96KQ7 2/20 0.34
EHMT1 Q9H9B1 2/20 0.34
NOS1 P29475 1/20 0.33
HRH3 Q9Y5N1 1/20 0.33
DHFR P00374 1/20 0.33
CDK1 P06493 1/20 0.33
CCNB1 P14635 1/20 0.33

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
SCHEMBL9618286 0.98 DNM1 (0.38) DNM1LMNAPKMSMN1; SMN2GPR84
SCHEMBL4419657 0.92 PTPN11 (0.39) LMNAPKMSMN1; SMN2TLR8TLR7
SCHEMBL14869532 0.89 LMNA (0.39) DNM1LMNAPKMSMN1; SMN2TLR8
SCHEMBL14869444 0.87 HSP90AA1 (0.37) DNM1LMNAPKMSMN1; SMN2TLR8
SCHEMBL14441524 0.86 DNM1 (0.50) DNM1GPR84EHMT2EHMT1
SCHEMBL14441520 0.86 DNM1 (0.50) DNM1GPR84EHMT2EHMT1
SCHEMBL14441522 0.86 DNM1 (0.50) DNM1GPR84EHMT2EHMT1
SCHEMBL14441521 0.86 DNM1 (0.50) DNM1GPR84EHMT2EHMT1
SCHEMBL14869506 0.84 CA1 (0.40) LMNAPKMSMN1; SMN2TLR8TLR7
SCHEMBL14869351 0.83 CA1 (0.35) DNM1LMNAPKMSMN1; SMN2TLR8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090041715-A1 Epothilone Combinations NOVARTIS AG (CH) 2009-02-12 US claimed
CN-1988904-A Epothilone combinations NOVARTIS AG (CH) 2007-06-27 CN claimed
EP-1773334-A1 EPOTHILONE COMBINATIONS Novartis AG (CH) 2007-04-18 EP claimed
WO-2006010585-A1 EPOTHILONE COMBINATIONS NOVARTIS AG (CH) 2006-02-02 WO claimed
US-20090041715-A1 Epothilone Combinations NOVARTIS AG (CH) 2009-02-12 US disclosed
CN-1988904-A Epothilone combinations NOVARTIS AG (CH) 2007-06-27 CN disclosed
EP-1773334-A1 EPOTHILONE COMBINATIONS Novartis AG (CH) 2007-04-18 EP disclosed
WO-2006010585-A1 EPOTHILONE COMBINATIONS NOVARTIS AG (CH) 2006-02-02 WO 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-20090041715-A1 Epothilone Combinations EPOR, ETV6, ERAL1 DNM1 2062/4885LMNA 2801/4885PKM 3054/4885

“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.