SCHEMBL4337102

SCHEMBL4337102

O=C(O)Nc1cccc(-c2cccc([N+](=O)[O-])c2O)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CXCR1 P25024 1/20 0.51
CXCR2 P25025 1/20 0.51
FBP1 P09467 3/20 0.47
GPR35 Q9HC97 1/20 0.47
ALOX5 P09917 1/20 0.46
KMT2A Q03164 7/20 0.45
MEN1 O00255 6/20 0.45
LMNA P02545 5/20 0.45
MAPT P10636 4/20 0.45
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
MAPK1 P28482 1/20 0.45
CRHBP P24387 1/20 0.44
CRHR2 Q13324 1/20 0.44
ALDH1A1 P00352 2/20 0.44
TDP1 Q9NUW8 1/20 0.44
P2RX1 P51575 1/20 0.43
HTT P42858 3/20 0.42
DDX3X O00571 1/20 0.42

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
SCHEMBL5605382 0.79 TDP1 (0.69) CXCR1CXCR2FBP1GPR35KMT2A
SCHEMBL4344095 0.79 HSD17B1 (0.48) GPR35SMN1; SMN2ALDH1A1TDP1L3MBTL1
SCHEMBL31415060 0.79 ERN1 (0.59) GPR35LMNAMAPTCRHBPCRHR2
SCHEMBL408308 0.79 ERN1 (0.59) GPR35LMNAMAPTCRHBPCRHR2
SCHEMBL2404857 0.76 CA2 (0.44) CXCR1CXCR2GPR35P2RX1L3MBTL1
SCHEMBL2405410 0.76 GPR35 (0.55) GPR35KMT2AMEN1MAPTSMN1; SMN2
Bromide SCHEMBL4334733 0.74 GPR35 (0.53) GPR35KMT2AMEN1MAPTSMN1; SMN2
SCHEMBL11309776 0.74 GPR35 (0.78) CXCR1CXCR2GPR35KMT2AMEN1
SCHEMBL2403547 0.73 GPR35 (0.55) GPR35LMNAALDH1A1TDP1L3MBTL1
SCHEMBL3463151 0.72 GPR35 (0.50) FBP1GPR35CRHBPCRHR2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130078213-A1 THROMBOPOIETIN MIMETICS GLAXOSMITHKLINE LLC 2013-03-28 US disclosed
EP-1889838-B1 Thrombopoietin mimetics SMITHKLINE BEECHAM CORP (US) 2009-10-14 EP disclosed
EP-1889838-A1 Thrombopoietin mimetics SmithKline Beecham Corporation (US) 2008-02-20 EP disclosed
EP-1864981-A1 Thrombopoietin mimetics SmithKline Beecham Corporation (US) 2007-12-12 EP disclosed
US-20070129338-A1 THROMBOPOIETIN MIMETICS SMITHKLINE BEECHAM CORPORATION 2007-06-07 US disclosed
US-20040019190-A1 Thrombopoietin mimetics NOVARTIS AG (CH) 2004-01-29 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-20070129338-A1 THROMBOPOIETIN MIMETICS MPL, THPO, TEK CXCR1 146/4885CXCR2 993/4885FBP1 1434/4885
US-20130078213-A1 THROMBOPOIETIN MIMETICS MPL, THPO, TEK CXCR1 146/4885CXCR2 993/4885FBP1 1434/4885

“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.