Flubendazole

Flubendazole

SCHEMBL453978

COC(=O)Nc1nc2cc(C(=O)c3ccc(F)cc3)ccc2[nH]1.COC(=O)Nc1nc2ccccc2[nH]1

nearest known ligand 0.78

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 3/20 0.78
MAPK1 P28482 2/20 0.78
ADORA3 P0DMS8 1/20 0.78
PTGS1 P23219 1/20 0.78
RXFP1 Q9HBX9 1/20 0.78
LMNA P02545 3/20 0.69
ALDH1A1 P00352 2/20 0.69
ABL1 P00519 2/20 0.69
CYP1A2 P05177 2/20 0.69
CYP2C9 P11712 2/20 0.69
HTT P42858 2/20 0.69
HIF1A Q16665 2/20 0.69
ABCC4 O15439 1/20 0.69
USP2 O75604 1/20 0.69
NPC1 O15118 8/20 0.62
RAB9A P51151 8/20 0.62
SMN1; SMN2 Q16637 5/20 0.62
TP53 P04637 3/20 0.62
PKM P14618 3/20 0.62
KDM4E B2RXH2 1/20 0.62

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
Flubendazole SCHEMBL8005889 0.94 KDR (0.76) KDRMAPK1ADORA3PTGS1RXFP1
Flubendazole SCHEMBL29409278 0.94 KDR (0.82) KDRMAPK1ADORA3PTGS1RXFP1
Flubendazole SCHEMBL167185 0.94 KDR (0.82) KDRMAPK1ADORA3PTGS1RXFP1
Flubendazole SCHEMBL22321861 0.93 KDR (0.80) KDRMAPK1ADORA3PTGS1RXFP1
Flubendazole SCHEMBL28005737 0.90 KDR (0.76) KDRMAPK1ADORA3PTGS1RXFP1
Mebendazole SCHEMBL15860 0.89 ABL1 (0.82) KDRMAPK1ADORA3PTGS1RXFP1
Mebendazole SCHEMBL29409261 0.89 ABL1 (0.82) KDRMAPK1ADORA3PTGS1RXFP1
Mebendazole SCHEMBL3429179 0.89 ABL1 (0.82) KDRMAPK1ADORA3PTGS1RXFP1
Mebendazole SCHEMBL21051203 0.88 ABL1 (0.80) KDRMAPK1ADORA3PTGS1RXFP1
Mebendazole SCHEMBL21051200 0.88 ABL1 (0.80) KDRMAPK1ADORA3PTGS1RXFP1

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
EP-2432451-A2 COMPOSITIONS FOR THE TREATMENT OF METASTATIC CANCER AND METHODS OF USE THEREOF Children's Medical Center Corporation (US) 2012-03-28 EP claimed
US-20120064008-A1 COMPOSITIONS FOR THE TREATMENT OF METASTATIC CANCER AND METHODS OF USE THEREOF CHILDREN'S MEDICAL CENTER CORPORATION 2012-03-15 US claimed
WO-2010135534-A2 COMPOSITIONS FOR THE TREATMENT OF METASTATIC CANCER AND METHODS OF USE THEREOF CHILDREN'S MEDICAL CENTER CORPORATION (US) 2010-11-25 WO claimed
EP-2432451-A2 COMPOSITIONS FOR THE TREATMENT OF METASTATIC CANCER AND METHODS OF USE THEREOF Children's Medical Center Corporation (US) 2012-03-28 EP disclosed
US-20120064008-A1 COMPOSITIONS FOR THE TREATMENT OF METASTATIC CANCER AND METHODS OF USE THEREOF CHILDREN'S MEDICAL CENTER CORPORATION 2012-03-15 US disclosed
WO-2010135534-A2 COMPOSITIONS FOR THE TREATMENT OF METASTATIC CANCER AND METHODS OF USE THEREOF CHILDREN'S MEDICAL CENTER CORPORATION (US) 2010-11-25 WO 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-20120064008-A1 COMPOSITIONS FOR THE TREATMENT OF METASTATIC CANCER AND METHODS OF USE THEREOF MKI67, ACP3, PAICS KDR 3035/4885MAPK1 2879/4885ADORA3 2452/4885

“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.