Benodanil

Benodanil

SCHEMBL9722166

O=C(Nc1ccccc1)c1ccccc1I.O=C(O)c1ccccc1I

nearest known ligand 0.89

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 0.89
KMT2A Q03164 7/20 0.89
TDP1 Q9NUW8 2/20 0.89
ALDH1A1 P00352 3/20 0.70
CYP3A4 P08684 1/20 0.64
CYP2C9 P11712 1/20 0.64
ALOX12 P18054 1/20 0.64
HPGD P15428 2/20 0.58
HTT P42858 2/20 0.58
LMNA P02545 2/20 0.58
KDM4E B2RXH2 1/20 0.58
TP53 P04637 1/20 0.58
HSD17B10 Q99714 1/20 0.58
METAP2 P50579 1/20 0.54
CHRNB2 P17787 1/20 0.54
CHRNB4 P30926 1/20 0.54
CHRNA3 P32297 1/20 0.54
CHRNA4 P43681 1/20 0.54
RXFP1 Q9HBX9 2/20 0.52
BCAT2 O15382 2/20 0.51

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
Benodanil SCHEMBL18736 0.94 MEN1 (1.00) MEN1KMT2ATDP1ALDH1A1CYP3A4
Benodanil SCHEMBL29402073 0.94 MEN1 (1.00) MEN1KMT2ATDP1ALDH1A1CYP3A4
Benodanil SCHEMBL28267472 0.83 MEN1 (0.78) MEN1KMT2ATDP1ALDH1A1CYP3A4
SCHEMBL1991348 0.83 ALDH1A1 (1.00) MEN1KMT2ATDP1ALDH1A1CYP3A4
SCHEMBL45299 0.83 ALDH1A1 (1.00) MEN1KMT2ATDP1ALDH1A1CYP3A4
SCHEMBL30516691 0.82 ALDH1A1 (0.65) MEN1KMT2ATDP1ALDH1A1HPGD
SCHEMBL40612 0.82 ALDH1A1 (0.65) MEN1KMT2ATDP1ALDH1A1HPGD
SCHEMBL23070511 0.82 MEN1 (0.71) MEN1KMT2ATDP1ALDH1A1HTT
SCHEMBL27493749 0.82 MEN1 (0.77) MEN1KMT2ATDP1ALDH1A1CYP3A4
SCHEMBL28496803 0.82 MEN1 (0.77) MEN1KMT2ATDP1ALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5129950-A Modulation of membrane dependent metabolism A NATTERMANN & CIE GMBH (DE) 1992-07-14 US disclosed
EP-0250583-A1 USE OF MEMBRANE MODULATORS AND PRODUCTS COMPRISING SUCH MEMBRANE MODULATORS A. Nattermann & Cie. GmbH (DE) 1988-01-07 EP disclosed
CN-87100159-A The application of film regulatory factor and contain the product of this film regulatory factor 1987-09-16 CN disclosed
EP-0231765-A1 Use of membrane modulators and products comprising such membrane modulators A. Nattermann & Cie. GmbH (DE) 1987-08-12 EP disclosed
WO-1987004048-A1 USE OF MEMBRANE MODULATORS AND PRODUCTS COMPRISING SUCH MEMBRANE MODULATORS A. NATTERMANN & CIE GMBH (DE) 1987-07-16 WO disclosed
EP-0068296-B1 A NEW FUNGICIDAL COMPOSITION, PROCESSES FOR ITS PRODUCTION AND ITS USE A. Nattermann & Cie. GmbH (DE) 1985-12-11 EP disclosed
EP-0068296-A1 A new fungicidal composition, processes for its production and its use A. Nattermann & Cie. GmbH (DE) 1983-01-05 EP disclosed