SCHEMBL17393743

SCHEMBL17393743

COc1ccc2[nH]c(-c3ccc(-c4noc(-c5ccc(C(F)(F)F)cc5)n4)cc3)nc2c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR1H4 Q96RI1 2/20 0.55
▸ LMNA P02545 2/20 0.51
▸ THRB P10828 1/20 0.51
▸ NPC1 O15118 5/20 0.49
▸ RAB9A P51151 4/20 0.49
▸ S1PR1 P21453 5/20 0.47
▸ SMN1; SMN2 Q16637 5/20 0.47
▸ NPSR1 Q6W5P4 2/20 0.47
▸ MAPT P10636 2/20 0.47
▸ POLB P06746 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ PTPN7 P35236 2/20 0.47
▸ BLM P54132 2/20 0.47
▸ WRN Q14191 2/20 0.47
▸ USP2 O75604 1/20 0.47
▸ CASP1 P29466 1/20 0.47
▸ HSD17B10 Q99714 1/20 0.47
▸ CHEK2 O96017 1/20 0.45
▸ EGFR P00533 1/20 0.45
▸ ALDH1A1 P00352 3/20 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
SCHEMBL17393727 0.94 NR1H4 (0.61) NR1H4LMNATHRBNPC1RAB9A
SCHEMBL17393439 0.90 NPC1 (0.58) NR1H4LMNANPC1RAB9AS1PR1
SCHEMBL17393420 0.89 RAB9A (0.53) NR1H4LMNATHRBNPC1RAB9A
SCHEMBL17393417 0.88 KMT2A (0.60) NR1H4LMNANPC1RAB9AS1PR1
SCHEMBL17393713 0.88 LMNA (0.55) LMNATHRBNPC1RAB9AS1PR1
SCHEMBL17393443 0.87 RAB9A (0.58) NR1H4LMNANPC1RAB9AS1PR1
SCHEMBL17393742 0.87 NR1H4 (0.64) NR1H4LMNANPC1RAB9AS1PR1
SCHEMBL17393373 0.86 SMN1; SMN2 (0.65) NR1H4LMNANPC1RAB9AS1PR1
SCHEMBL17393278 0.86 LMNA (0.57) LMNATHRBNPC1RAB9AS1PR1
SCHEMBL17393702 0.86 RAB9A (0.60) NR1H4LMNANPC1RAB9AS1PR1

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 NR1H4 1157/4885LMNA 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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