SCHEMBL7753940

SCHEMBL7753940

O=C(Cc1ccc(Cl)cc1)Nc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.59
MEN1 O00255 3/20 0.59
ALDH1A1 P00352 2/20 0.57
MAPT P10636 1/20 0.57
HTT P42858 1/20 0.57
LMNA P02545 2/20 0.55
L3MBTL1 Q9Y468 2/20 0.53
SMN1; SMN2 Q16637 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
SCHEMBL6546363 0.92 LMNA (0.64) KMT2AMEN1ALDH1A1MAPTLMNA
SCHEMBL7754088 0.90 KMT2A (0.58) KMT2AALDH1A1MAPTLMNAL3MBTL1
SCHEMBL6546924 0.89 KMT2A (0.57) KMT2AMEN1ALDH1A1MAPTHTT
SCHEMBL6545821 0.89 L3MBTL1 (0.68) KMT2AMEN1ALDH1A1MAPTLMNA
SCHEMBL7749311 0.86 KMT2A (0.54) KMT2AMEN1ALDH1A1MAPTLMNA
SCHEMBL11883066 0.84 ALDH1A1 (0.63) KMT2AMEN1ALDH1A1MAPTHTT
SCHEMBL7753274 0.82 SMN1; SMN2 (0.55) KMT2AMEN1ALDH1A1MAPTLMNA
SCHEMBL31541287 0.82 MEN1 (0.52) KMT2AMEN1ALDH1A1MAPTHTT
SCHEMBL11157919 0.82 MEN1 (0.52) KMT2AMEN1ALDH1A1MAPTHTT
SCHEMBL7754151 0.81 LMNA (0.66) KMT2AMEN1ALDH1A1MAPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1068176-A1 CYSTEINE AMIDES AS FARNESYL TRANSFERASE INHIBITORS Jomaa, Hassan (DE) 2001-01-17 EP disclosed
WO-2000027803-A1 CYSTEINE AMIDES AS FARNESYL TRANSFERASE INHIBITORS JOMAA, HASSAN (DE) 2000-05-18 WO disclosed