SCHEMBL9508402

SCHEMBL9508402

Cc1ccc(CNC(=O)CNC(=O)C2(C)CC2(Cl)Cl)cc1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.50
MEN1 O00255 3/20 0.50
NPC1 O15118 3/20 0.50
ALDH1A1 P00352 3/20 0.50
RAB9A P51151 3/20 0.50
SMN1; SMN2 Q16637 3/20 0.48
LMNA P02545 1/20 0.47
HPGD P15428 3/20 0.45
NPSR1 Q6W5P4 1/20 0.45
CA12 O43570 1/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA7 P43166 1/20 0.45
TP53 P04637 1/20 0.45
TDP1 Q9NUW8 1/20 0.45

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
SCHEMBL9509533 0.89 SMN1; SMN2 (0.48) KMT2AMEN1NPC1ALDH1A1RAB9A
SCHEMBL9788334 0.89 MEN1 (0.53) KMT2AMEN1NPC1ALDH1A1RAB9A
SCHEMBL14679449 0.76 KMT2A (0.57) KMT2AMEN1NPC1ALDH1A1RAB9A
SCHEMBL14679398 0.74 CA1 (0.64) KMT2AMEN1NPC1ALDH1A1RAB9A
SCHEMBL14617667 0.74 SMN1; SMN2 (0.81) KMT2AMEN1NPC1ALDH1A1RAB9A
SCHEMBL11731507 0.72 KMT2A (0.65) KMT2AMEN1NPC1ALDH1A1RAB9A
SCHEMBL2730689 0.71 SMN1; SMN2 (0.85) KMT2AMEN1NPC1ALDH1A1RAB9A
SCHEMBL13932527 0.70 KMT2A (0.83) KMT2AMEN1NPC1ALDH1A1RAB9A
SCHEMBL9508408 0.70 HPGD (0.61) KMT2AMEN1ALDH1A1RAB9ASMN1; SMN2
SCHEMBL660986 0.70 KMT2A (0.62) KMT2AMEN1NPC1ALDH1A1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-3017051-A None JP disclosed
EP-0398059-B1 CYCLOPROPANOYLAMINOACID AMIDE DERIVATIVES BAYER AG (DE) 1993-08-25 EP disclosed
US-5034408-A Fungicides of dihalocyclopropanoylamino acid amides BAYER AKTIENGESELLSCHAFT (DE) 1991-07-23 US disclosed
JP-H0317051-A CYCLOPROPANOYLAMINO ACID AMIDE DERIVATIVE BAYER AG 1991-01-25 JP disclosed
EP-0398059-A1 Cyclopropanoylaminoacid amide derivatives BAYER AG (DE) 1990-11-22 EP disclosed