SCHEMBL2811039

SCHEMBL2811039

CCC(=COc1ccccc1OC)C(=O)Nc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.48
MTNR1B P49286 1/20 0.46
RAB9A P51151 4/20 0.45
NPC1 O15118 2/20 0.45
CASP3 P42574 1/20 0.45
SENP7 Q9BQF6 1/20 0.45
KMT2A Q03164 5/20 0.45
MEN1 O00255 3/20 0.45
HIF1A Q16665 2/20 0.44
HDAC3 O15379 1/20 0.44
HDAC4 P56524 1/20 0.44
HDAC1 Q13547 1/20 0.44
HDAC7 Q8WUI4 1/20 0.44
HDAC2 Q92769 1/20 0.44
HDAC10 Q969S8 1/20 0.44
HDAC11 Q96DB2 1/20 0.44
HDAC8 Q9BY41 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
HDAC9 Q9UKV0 1/20 0.44
HDAC5 Q9UQL6 1/20 0.44

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
SCHEMBL2811036 1.00 NPSR1 (0.48) NPSR1MTNR1BRAB9ANPC1CASP3
SCHEMBL2808836 0.91 MTNR1B (0.46) MTNR1BRAB9ANPC1KMT2AMEN1
SCHEMBL2808833 0.91 MTNR1B (0.46) MTNR1BRAB9ANPC1KMT2AMEN1
SCHEMBL2807358 0.84 KMT2A (0.54) RAB9ANPC1KMT2AMEN1HIF1A
SCHEMBL2807360 0.84 KMT2A (0.54) RAB9ANPC1KMT2AMEN1HIF1A
SCHEMBL2813927 0.83 ALDH1A1 (0.46) RAB9ANPC1KMT2AHDAC3HDAC4
SCHEMBL2813929 0.83 ALDH1A1 (0.46) RAB9ANPC1KMT2AHDAC3HDAC4
SCHEMBL2812376 0.83 POLB (0.47) MTNR1BNPC1KMT2AMEN1SMN1; SMN2
SCHEMBL2812380 0.83 POLB (0.47) MTNR1BNPC1KMT2AMEN1SMN1; SMN2
SCHEMBL2809083 0.82 NPSR1 (0.48) NPSR1RAB9ANPC1CASP3SENP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8278473-B2 Alpha, beta-unsaturated imidate compound and pesticidal composition containing the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-10-02 US disclosed
US-20100240729-A1 ALPHA, BETA-UNSATURATED IMIDATE COMPOUND AND PESTICIDAL COMPOSITION CONTAINING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-09-23 US disclosed
WO-2009064031-A1 ALPHA, BETA-UNSATURATED IMIDATE COMPOUND AND PESTICIDAL COMPOSITION CONTAINING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-05-22 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100240729-A1 ALPHA, BETA-UNSATURATED IMIDATE COMPOUND AND PESTICIDAL COMPOSITION CONTAINING THE SAME OXER1, CBR1, DEGS1 NPSR1 967/4885MTNR1B 1298/4885RAB9A 1842/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.