SCHEMBL9762607

SCHEMBL9762607

CCNc1c(N)nsc1[N+](=O)[O-]

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.33
ALDH1A1 P00352 1/20 0.32
PGK1 P00558 1/20 0.31
GAA P10253 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
MAPK8 P45983 1/20 0.30
MAPK9 P45984 1/20 0.30

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
SCHEMBL9761776 0.78 MAPT (0.33) MAPTSMN1; SMN2ALDH1A1PGK1
SCHEMBL9761403 0.70 ALDH1A1 (0.32) MAPTALDH1A1
SCHEMBL9762165 0.69 KMT2A (0.44) MAPTSMN1; SMN2ALDH1A1GAATDP1
SCHEMBL9761831 0.67 CCR6 (0.33) MAPTSMN1; SMN2ALDH1A1
SCHEMBL10400450 0.64 MAPT (0.40) MAPTSMN1; SMN2ALDH1A1PGK1GAA
SCHEMBL9761813 0.62
SCHEMBL9789043 0.60 PGK1 (0.40) MAPTSMN1; SMN2ALDH1A1PGK1MAPK8
SCHEMBL10270164 0.59 PGK1 (0.42) MAPTALDH1A1PGK1
SCHEMBL6118560 0.58 TDP1 (0.52) MAPTSMN1; SMN2ALDH1A1PGK1TDP1
SCHEMBL11651962 0.58 GAA (0.39) MAPTSMN1; SMN2ALDH1A1PGK1GAA

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
US-5026694-A Antitumor agents THE BRITISH COLUMBIA CANCER FOUNDATION (CA) 1991-06-25 US disclosed