SCHEMBL774750

SCHEMBL774750

O=C(Nc1nnc(-c2ccccc2)o1)c1ccc(Cl)c(-c2ccc(-c3ccccc3)cc2)c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.68
LMNA P02545 5/20 0.68
SMN1; SMN2 Q16637 2/20 0.68
OPRK1 P41145 2/20 0.68
CCR6 P51684 2/20 0.68
TDP1 Q9NUW8 2/20 0.68
ALOX15 P16050 1/20 0.68
ALOX12 P18054 1/20 0.68
CXCR5 P32302 1/20 0.68
APLNR P35414 1/20 0.68
ADCY1 Q08828 9/20 0.65
ADCY8 P40145 2/20 0.65
HTT P42858 4/20 0.60
L3MBTL1 Q9Y468 4/20 0.57
HPGD P15428 2/20 0.57
ALDH1A1 P00352 2/20 0.56
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
TP53 P04637 1/20 0.55
MAPK1 P28482 1/20 0.55

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
SCHEMBL30656648 0.88 KDM4E (0.74) KDM4ELMNASMN1; SMN2OPRK1CCR6
SCHEMBL26665265 0.88 KDM4E (0.74) KDM4ELMNASMN1; SMN2OPRK1CCR6
SCHEMBL26665270 0.81 KDM4E (1.00) KDM4ELMNASMN1; SMN2OPRK1CCR6
SCHEMBL30656644 0.81 KDM4E (0.77) KDM4ELMNASMN1; SMN2OPRK1CCR6
SCHEMBL26665250 0.81 KDM4E (0.77) KDM4ELMNASMN1; SMN2OPRK1CCR6
SCHEMBL26665246 0.80 KDM4E (0.78) KDM4ELMNASMN1; SMN2OPRK1CCR6
SCHEMBL28823005 0.79 KDM4E (0.83) KDM4ELMNASMN1; SMN2OPRK1CCR6
SCHEMBL17717009 0.79 KDM4E (0.87) KDM4ELMNASMN1; SMN2OPRK1CCR6
SCHEMBL20598356 0.79 ADCY1 (1.00) KDM4ELMNASMN1; SMN2OPRK1CCR6
SCHEMBL20598211 0.78 ADCY1 (1.00) KDM4ELMNASMN1; SMN2TDP1ADCY1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120071513-A1 Compositions and Their Use as Anti-Tumor Agents COMPASS PHARMACEUTICALS LLC (US) 2012-03-22 US claimed
US-20110178087-A1 Compositions and Their Use as Anti-Tumor Agents Compass Pharmaceuticals LLC. (US) 2011-07-21 US claimed
EP-1802606-B1 ARYLCARBOXAMIDES AND THEIR USE AS ANTI-TUMOR AGENTS COMPASS PHARMACEUTICALS LLC (US) 2011-03-16 EP claimed
US-20090018145-A1 Compositions and their use as anti-tumor agents COMPASS PHARMACEUTICALS LLC (US) 2009-01-15 US claimed
EP-2520575-B1 1,3,4-OXADIAZOLE-2-CARBOXAMIDE COMPOUND GEN INC ASS PHARMA VALLEY PROJECT SUPPORTING ORGANIZATION (JP) 2016-11-30 EP disclosed
US-8796320-B2 1,3,4-Oxadiazole-2-carboxamide compound GENERAL INCORPORATED ASSOCIATION PHARMA VALLEY PROJECT SUPPORTING ORGANIZATION (JP) 2014-08-05 US disclosed
US-20120302524-A1 1,3,4-OXADIAZOLE-2-CARBOXAMIDE COMPOUND GENERAL INCORPORATED ASSOCIATION PHARMA VALLEY PROJECT SUPPORTING ORGANIZATION (JP) 2012-11-29 US disclosed
EP-2520575-A1 1,3,4-OXADIAZOLE-2-CARBOXAMIDE COMPOUND General Incorporated Association Pharma Valley Project Supporting Organization (JP) 2012-11-07 EP disclosed
US-20120071513-A1 Compositions and Their Use as Anti-Tumor Agents COMPASS PHARMACEUTICALS LLC (US) 2012-03-22 US disclosed
US-20110178087-A1 Compositions and Their Use as Anti-Tumor Agents Compass Pharmaceuticals LLC. (US) 2011-07-21 US disclosed
WO-2011081205-A1 1,3,4-OXADIAZOLE-2-CARBOXAMIDE COMPOUND 一般社団法人ファルマIP (JP) 2011-07-07 WO disclosed
EP-1802606-B1 ARYLCARBOXAMIDES AND THEIR USE AS ANTI-TUMOR AGENTS COMPASS PHARMACEUTICALS LLC (US) 2011-03-16 EP disclosed
US-20090018145-A1 Compositions and their use as anti-tumor agents COMPASS PHARMACEUTICALS LLC (US) 2009-01-15 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 (4 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-20120071513-A1 Compositions and Their Use as Anti-Tumor Agents TP53, VHL, RB1 KDM4E 3233/4885LMNA 751/4885SMN1; SMN2 206/4885
US-20120302524-A1 1,3,4-OXADIAZOLE-2-CARBOXAMIDE COMPOUND STAT3, JAK2, STAT5A KDM4E 480/4885LMNA 4594/4885SMN1; SMN2 3613/4885
US-20110178087-A1 Compositions and Their Use as Anti-Tumor Agents TP53, VHL, RB1 KDM4E 3233/4885LMNA 751/4885SMN1; SMN2 206/4885
US-20090018145-A1 Compositions and their use as anti-tumor agents TP53, VHL, RB1 KDM4E 3241/4885LMNA 756/4885SMN1; SMN2 214/4885

“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.