SCHEMBL8493502

SCHEMBL8493502

CCC(=NN(C)c1ccccc1)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 1/20 0.57
▸ ALDH1A1 P00352 8/20 0.48
▸ MAPT P10636 4/20 0.48
▸ SMN1; SMN2 Q16637 4/20 0.48
▸ RAB9A P51151 3/20 0.48
▸ LMNA P02545 2/20 0.48
▸ TP53 P04637 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.40
▸ KMT2A Q03164 3/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ HIF1A Q16665 1/20 0.38
▸ CES2 O00748 1/20 0.37
▸ CES1 P23141 1/20 0.37
▸ HTT P42858 2/20 0.37
▸ GAA P10253 1/20 0.37
▸ ESR1 P03372 2/20 0.37
▸ CYP19A1 P11511 1/20 0.37
▸ ESR2 Q92731 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ GFER P55789 1/20 0.37

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
SCHEMBL8493498 1.00 ATM (0.57) ATMALDH1A1MAPTSMN1; SMN2RAB9A
SCHEMBL8496723 0.91 MEN1 (0.50) ATMALDH1A1MAPTSMN1; SMN2RAB9A
SCHEMBL8496724 0.91 MEN1 (0.50) ATMALDH1A1MAPTSMN1; SMN2RAB9A
SCHEMBL8498707 0.89 ATM (0.44) ATMALDH1A1MAPTSMN1; SMN2RAB9A
SCHEMBL8498706 0.89 ATM (0.44) ATMALDH1A1MAPTSMN1; SMN2RAB9A
SCHEMBL8499194 0.86 KDM4E (0.47) ATMALDH1A1MAPTSMN1; SMN2RAB9A
SCHEMBL8499190 0.86 KDM4E (0.47) ATMALDH1A1MAPTSMN1; SMN2RAB9A
SCHEMBL8498042 0.83 ATM (0.59) ATMALDH1A1MAPTSMN1; SMN2RAB9A
SCHEMBL8498045 0.83 ATM (0.59) ATMALDH1A1MAPTSMN1; SMN2RAB9A
SCHEMBL27487152 0.79 MEN1 (0.42) ATMALDH1A1MAPTSMN1; SMN2RAB9A

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
WO-1999040062-A1 HYDRAZONE DERIVATIVES NOVO NORDISK A/S (DK) 1999-08-12 — — WO disclosed
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