SCHEMBL27656657

SCHEMBL27656657

C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1O)c1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 4/20 0.64
▸ MEN1 O00255 4/20 0.64
▸ KMT2A Q03164 4/20 0.64
▸ MAPT P10636 3/20 0.64
▸ ALDH1A1 P00352 4/20 0.62
▸ KDM4E B2RXH2 2/20 0.62
▸ HPGD P15428 1/20 0.62
▸ HSD17B10 Q99714 1/20 0.62
▸ KCNMA1 Q12791 2/20 0.51
▸ CRHBP P24387 1/20 0.51
▸ CRHR2 Q13324 1/20 0.51
▸ PHGDH O43175 1/20 0.51
▸ L3MBTL1 Q9Y468 2/20 0.50
▸ HTT P42858 1/20 0.50
▸ NPC1 O15118 1/20 0.50
▸ HSP90AA1 P07900 1/20 0.50
▸ PKM P14618 1/20 0.50
▸ PAX8 Q06710 1/20 0.50
▸ NPSR1 Q6W5P4 1/20 0.50
▸ POLB P06746 1/20 0.49

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
SCHEMBL27656560 1.00 LMNA (0.64) LMNAMEN1KMT2AMAPTALDH1A1
SCHEMBL31546660 0.86 LMNA (0.63) LMNAMEN1KMT2AMAPTALDH1A1
SCHEMBL28257375 0.85 LMNA (0.61) LMNAMEN1KMT2AMAPTALDH1A1
SCHEMBL31546635 0.84 ALDH1A1 (0.64) LMNAMEN1KMT2AMAPTALDH1A1
SCHEMBL10768107 0.80 NPC1 (0.65) LMNAMEN1KMT2AMAPTALDH1A1
SCHEMBL10763115 0.80 NPC1 (0.65) LMNAMEN1KMT2AMAPTALDH1A1
SCHEMBL10763104 0.80 NPC1 (0.65) LMNAMEN1KMT2AMAPTALDH1A1
SCHEMBL27876824 0.79 LMNA (0.64) LMNAMEN1KMT2AMAPTALDH1A1
SCHEMBL27876821 0.79 LMNA (0.64) LMNAMEN1KMT2AMAPTALDH1A1
SCHEMBL31546622 0.79 ALDH1A1 (0.63) LMNAMEN1KMT2AMAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1944398-A New benzoyl amide compounds and its preparing method and medicine use INST OF MEDICINES CHINESE ACAD (CN) 2007-04-11 — — CN disclosed
Send feedback