SCHEMBL17393427

SCHEMBL17393427

COc1ccc2[nH]c(-c3ccc(-c4noc(-c5ccc(OC)c(OC)c5)n4)cc3)nc2c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 9/20 0.57
▸ NPC1 O15118 8/20 0.57
▸ MAPT P10636 7/20 0.57
▸ GUSB P08236 1/20 0.53
▸ KDM4E B2RXH2 6/20 0.53
▸ HSD17B10 Q99714 5/20 0.53
▸ ALDH1A1 P00352 4/20 0.53
▸ HPGD P15428 3/20 0.53
▸ LMNA P02545 1/20 0.53
▸ RAB9A P51151 6/20 0.52
▸ TSHR P16473 4/20 0.52
▸ HTT P42858 2/20 0.52
▸ NPSR1 Q6W5P4 2/20 0.50
▸ TP53 P04637 1/20 0.50
▸ NFKB1 P19838 1/20 0.50
▸ NFKB2 Q00653 1/20 0.50
▸ RELA Q04206 1/20 0.50
▸ MEN1 O00255 1/20 0.48
▸ KMT2A Q03164 1/20 0.48
▸ S1PR1 P21453 2/20 0.48

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
SCHEMBL17393725 0.90 MAOB (0.54) SMN1; SMN2MAPTKDM4EHSD17B10ALDH1A1
SCHEMBL17393439 0.90 NPC1 (0.58) SMN1; SMN2NPC1MAPTKDM4EHSD17B10
SCHEMBL17393262 0.89 SMN1; SMN2 (0.57) SMN1; SMN2NPC1MAPTGUSBKDM4E
SCHEMBL17393270 0.89 SMN1; SMN2 (0.61) SMN1; SMN2NPC1MAPTGUSBKDM4E
SCHEMBL17393415 0.88 SMN1; SMN2 (0.61) SMN1; SMN2NPC1MAPTGUSBKDM4E
SCHEMBL17393505 0.88 SMN1; SMN2 (0.56) SMN1; SMN2NPC1MAPTGUSBKDM4E
SCHEMBL17393702 0.88 RAB9A (0.60) SMN1; SMN2NPC1MAPTKDM4EHSD17B10
SCHEMBL17393623 0.87 SMN1; SMN2 (0.59) SMN1; SMN2NPC1MAPTGUSBKDM4E
SCHEMBL17393443 0.87 RAB9A (0.58) SMN1; SMN2NPC1MAPTKDM4EHSD17B10
SCHEMBL17393742 0.87 NR1H4 (0.64) SMN1; SMN2NPC1MAPTKDM4EHSD17B10

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 SMN1; SMN2 3599/4885NPC1 625/4885MAPT 4875/4885

“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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