SCHEMBL11224820

SCHEMBL11224820

CC(=O)C(C)=NOC(=O)Nc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.53
KMT2A Q03164 3/20 0.53
MEN1 O00255 2/20 0.53
MAPT P10636 1/20 0.53
RAB9A P51151 4/20 0.51
GAA P10253 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
KDM4E B2RXH2 1/20 0.50
NAPRT Q6XQN6 1/20 0.50
HSD17B10 Q99714 1/20 0.50
HTR1A P08908 1/20 0.48
ADORA3 P0DMS8 1/20 0.48
CCKAR P32238 1/20 0.48
HTR5A P47898 1/20 0.48
FAAH O00519 1/20 0.48
NPC1 O15118 2/20 0.47

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
SCHEMBL1674417 0.86 FAAH (0.62) ALDH1A1KMT2AMEN1MAPTRAB9A
SCHEMBL13172256 0.81 HTR1A (0.63) ALDH1A1KMT2AMEN1MAPTRAB9A
SCHEMBL15386131 0.80 FAAH (0.52) ALDH1A1KMT2AMEN1MAPTRAB9A
SCHEMBL10871360 0.79 ALDH1A1 (0.49) ALDH1A1KMT2AMEN1MAPTRAB9A
SCHEMBL13626630 0.76 HTR1A (0.61) ALDH1A1KMT2AMEN1MAPTSMN1; SMN2
SCHEMBL4311261 0.76 HTR1A (0.61) ALDH1A1KMT2AMEN1MAPTSMN1; SMN2
SCHEMBL1577066 0.76 FAAH (0.73) KMT2AMEN1RAB9ASMN1; SMN2FAAH
SCHEMBL1576951 0.74 FAAH (0.66) HTR1AADORA3CCKARHTR5AFAAH
SCHEMBL11151343 0.74 RAB9A (0.59) ALDH1A1KMT2AMEN1MAPTRAB9A
SCHEMBL4323726 0.73 HTR1A (0.74) KMT2AMEN1KDM4EHTR1AADORA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4343885-A PHOTORESISTS DYNACHEM CORPORATION (US) 1982-08-10 US disclosed
EP-0005380-B1 PHOTOTROPIC PHOTOSENSITIVE COMPOSITIONS CONTAINING A FLUORAN COLORFORMER Dynachem Corporation (US) 1982-01-06 EP disclosed
EP-0005380-A2 Phototropic photosensitive compositions containing a fluoran colorformer Dynachem Corporation (US) 1979-11-14 EP disclosed