SCHEMBL9669673

SCHEMBL9669673

CCC(=O)NN=Cc1c[nH]c2ccccc12

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 1/20 0.71
ALDH1A1 P00352 4/20 0.70
SMN1; SMN2 Q16637 3/20 0.70
MEN1 O00255 11/20 0.70
KMT2A Q03164 11/20 0.70
HPGD P15428 1/20 0.70
MAPT P10636 9/20 0.67
GAA P10253 2/20 0.67
RAB9A P51151 2/20 0.66
TUBB4A P04350 1/20 0.66
TUBB P07437 1/20 0.66
TUBA3C P0DPH7 1/20 0.66
TUBA1B P68363 1/20 0.66
TUBA4A P68366 1/20 0.66
TUBB4B P68371 1/20 0.66
TUBB3 Q13509 1/20 0.66
TUBB2A Q13885 1/20 0.66
TUBB8 Q3ZCM7 1/20 0.66
TUBA3E Q6PEY2 1/20 0.66
TUBA1A Q71U36 1/20 0.66

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
SCHEMBL25605905 0.86 MEN1 (0.69) PTGS2ALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL13381082 0.84 MEN1 (0.70) PTGS2ALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL27131245 0.83 PTGS2 (1.00) PTGS2ALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL24629107 0.83 PTGS2 (1.00) PTGS2ALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL9668293 0.83 RAB9A (0.77) PTGS2ALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL9668297 0.83 RAB9A (0.77) PTGS2ALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL22925016 0.82 ALDH1A1 (1.00) PTGS2ALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL25605398 0.82 MEN1 (0.64) PTGS2ALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL8257172 0.82 MAPT (0.74) PTGS2ALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL9669033 0.81 SMN1; SMN2 (0.70) PTGS2ALDH1A1SMN1; SMN2MEN1KMT2A

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
EP-0299973-B1 ANTHELMINTIC ACYLHYDRAZONES, METHOD OF USE AND COMPOSITIONS THE UPJOHN COMPANY (US) 1992-06-17 EP claimed