SCHEMBL17393432

SCHEMBL17393432

Fc1ccc(-c2nc(-c3ccc(-c4nc5cc(C(F)(F)F)ccc5[nH]4)cc3)no2)cc1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ NPBWR1 P48145 6/20 0.49
▸ LMNA P02545 1/20 0.49
▸ THRB P10828 1/20 0.49
▸ S1PR1 P21453 7/20 0.48
▸ PSMD11 O00231 1/20 0.47
▸ DGAT1 O75907 3/20 0.47
▸ KCNH2 Q12809 3/20 0.47
▸ GUSB P08236 1/20 0.46
▸ KDM4E B2RXH2 1/20 0.45
▸ NPC1 O15118 1/20 0.45
▸ RAB9A P51151 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ S1PR3 Q99500 1/20 0.45
▸ SOAT1 P35610 1/20 0.44

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
SCHEMBL17393713 0.94 LMNA (0.55) NPBWR1LMNATHRBS1PR1DGAT1
SCHEMBL17415753 0.93 LMNA (0.52) NPBWR1LMNATHRBS1PR1PSMD11
SCHEMBL17393442 0.91 DGAT1 (0.59) NPBWR1LMNATHRBS1PR1DGAT1
SCHEMBL17393275 0.91 NPBWR1 (0.49) NPBWR1LMNATHRBS1PR1DGAT1
SCHEMBL17393250 0.90 S1PR1 (0.49) NPBWR1LMNATHRBS1PR1DGAT1
SCHEMBL17393283 0.88 PSMD11 (0.53) PSMD11GUSBKDM4ENPC1RAB9A
SCHEMBL17393727 0.87 NR1H4 (0.61) NPBWR1LMNATHRBS1PR1DGAT1
SCHEMBL17393388 0.86 LMNA (0.52) NPBWR1LMNATHRBS1PR1DGAT1
SCHEMBL17393278 0.85 LMNA (0.57) NPBWR1LMNATHRBS1PR1DGAT1
SCHEMBL17393622 0.85 S1PR1 (0.52) NPBWR1LMNATHRBS1PR1DGAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9522907-B2 Anticancer agent and process for the preparation thereof COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2016-12-20 — — US claimed
EP-2966073-B1 DERIVATIVES OF 1-(BENZIMIDAZOL-2-YL)-4-(5-PHENYL-1,2,4-OXADIAZOL-3-YL)-BENZENE USEFUL AS ANTICANCER AGENTS AND PROCESS FOR THE PREPARATION THEREOF COUNCIL SCIENT IND RES (IN) 2016-12-14 — — EP claimed
EP-2966073-A1 DERIVATIVES OF 1-(BENZIMIDAZOL-2-YL)-4-(5-PHENYL-1,2,4-OXADIAZOL-3-YL)-BENZENE USEFUL AS ANTICANCER AGENTS AND PROCESS FOR THE PREPARATION THEREOF Council of Scientific & Industrial Research (IN) 2016-01-13 — — EP claimed
US-20160002214-A1 ANTICANCER AGENT AND PROCESS FOR THE PREPARATION THEREOF COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2016-01-07 — — US claimed
US-9522907-B2 Anticancer agent and process for the preparation thereof COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2016-12-20 — — US disclosed
EP-2966073-B1 DERIVATIVES OF 1-(BENZIMIDAZOL-2-YL)-4-(5-PHENYL-1,2,4-OXADIAZOL-3-YL)-BENZENE USEFUL AS ANTICANCER AGENTS AND PROCESS FOR THE PREPARATION THEREOF COUNCIL SCIENT IND RES (IN) 2016-12-14 — — EP disclosed
EP-2966073-B1 DERIVATIVES OF 1-(BENZIMIDAZOL-2-YL)-4-(5-PHENYL-1,2,4-OXADIAZOL-3-YL)-BENZENE USEFUL AS ANTICANCER AGENTS AND PROCESS FOR THE PREPARATION THEREOF COUNCIL SCIENT IND RES (IN) 2016-12-14 — — EP disclosed
EP-2966073-A1 DERIVATIVES OF 1-(BENZIMIDAZOL-2-YL)-4-(5-PHENYL-1,2,4-OXADIAZOL-3-YL)-BENZENE USEFUL AS ANTICANCER AGENTS AND PROCESS FOR THE PREPARATION THEREOF Council of Scientific & Industrial Research (IN) 2016-01-13 — — EP disclosed
EP-2966073-A1 DERIVATIVES OF 1-(BENZIMIDAZOL-2-YL)-4-(5-PHENYL-1,2,4-OXADIAZOL-3-YL)-BENZENE USEFUL AS ANTICANCER AGENTS AND PROCESS FOR THE PREPARATION THEREOF Council of Scientific & Industrial Research (IN) 2016-01-13 — — EP 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-20160002214-A1 ANTICANCER AGENT AND PROCESS FOR THE PREPARATION THEREOF ABCC3, CASP3, ABCC4 NPBWR1 3746/4885LMNA 1911/4885THRB 4039/4885

“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.

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