SCHEMBL11425344

SCHEMBL11425344

CN(C)c1ccc(N=C2C=CC(=O)C(NC(N)=O)=C2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PABPC1 P11940 1/20 0.41
▸ ADRA2A P08913 4/20 0.39
▸ ADRA2B P18089 2/20 0.39
▸ ADRA2C P18825 2/20 0.39
▸ NOS1 P29475 3/20 0.38
▸ KMT2A Q03164 4/20 0.35
▸ NPC1 O15118 3/20 0.35
▸ MEN1 O00255 3/20 0.35
▸ MAPK1 P28482 2/20 0.35
▸ MAPT P10636 2/20 0.35
▸ RAB9A P51151 2/20 0.35
▸ POLB P06746 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ F2 P00734 3/20 0.35
▸ PRSS1 P07477 3/20 0.35
▸ PRSS2 P07478 3/20 0.35
▸ PRSS3 P35030 3/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ TP53 P04637 1/20 0.35
▸ TSHR P16473 1/20 0.35

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
SCHEMBL11316014 0.88 PABPC1 (0.42) PABPC1ADRA2AADRA2BADRA2CNOS1
SCHEMBL11308089 0.79 PABPC1 (0.48) PABPC1ADRA2AADRA2BADRA2CNOS1
SCHEMBL11321519 0.79 PABPC1 (0.52) PABPC1ADRA2AADRA2BADRA2CNOS1
SCHEMBL13845511 0.75 ALDH1A1 (0.41) KMT2ANPC1MEN1MAPK1MAPT
SCHEMBL2680700 0.75 PABPC1 (0.56) PABPC1ADRA2AADRA2BADRA2CNOS1
SCHEMBL10000303 0.73 ESRRG (0.33) KMT2ANPC1MEN1MAPTRAB9A
SCHEMBL9488788 0.72 PABPC1 (0.47) PABPC1ADRA2AADRA2BADRA2CNOS1
SCHEMBL11626295 0.70 — —
SCHEMBL11321038 0.70 PABPC1 (0.42) PABPC1ADRA2AADRA2BADRA2CNOS1
SCHEMBL126305 0.69 PABPC1 (0.60) PABPC1ADRA2AADRA2BADRA2CNOS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4221729-A HAIR DYES L'OREAL (FR) 1980-09-09 — — US claimed
US-4221729-A HAIR DYES L'OREAL (FR) 1980-09-09 — — US disclosed
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