SCHEMBL8496724

SCHEMBL8496724

CCC(=NN(C)c1ccccc1)c1ccc(O)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.50
▸ KMT2A Q03164 3/20 0.50
▸ ATM Q13315 1/20 0.47
▸ ESR1 P03372 13/20 0.45
▸ ESR2 Q92731 7/20 0.45
▸ CYP19A1 P11511 1/20 0.45
▸ LMNA P02545 5/20 0.44
▸ MAPT P10636 5/20 0.44
▸ ALDH1A1 P00352 4/20 0.44
▸ SMN1; SMN2 Q16637 2/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ MAPK1 P28482 2/20 0.41
▸ HSD17B10 Q99714 2/20 0.41
▸ TP53 P04637 2/20 0.41
▸ PGR P06401 2/20 0.41
▸ CYP3A4 P08684 2/20 0.41
▸ ESRRG P62508 2/20 0.41
▸ HIF1A Q16665 2/20 0.41
▸ NPSR1 Q6W5P4 2/20 0.41
▸ NR1I2 O75469 1/20 0.41

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
SCHEMBL8496723 1.00 MEN1 (0.50) MEN1KMT2AATMESR1ESR2
SCHEMBL8493498 0.91 ATM (0.57) MEN1KMT2AATMESR1ESR2
SCHEMBL8493502 0.91 ATM (0.57) MEN1KMT2AATMESR1ESR2
SCHEMBL8498707 0.87 ATM (0.44) MEN1KMT2AATMLMNAMAPT
SCHEMBL8498706 0.87 ATM (0.44) MEN1KMT2AATMLMNAMAPT
SCHEMBL8499194 0.84 KDM4E (0.47) MEN1KMT2AATMLMNAMAPT
SCHEMBL8499190 0.84 KDM4E (0.47) MEN1KMT2AATMLMNAMAPT
SCHEMBL8497145 0.80 MEN1 (0.52) MEN1KMT2AATMESR1ESR2
SCHEMBL8497147 0.80 MEN1 (0.52) MEN1KMT2AATMESR1ESR2
SCHEMBL8496840 0.78 G6PC1 (0.53) MEN1KMT2AATMESR1ESR2

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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