SCHEMBL2591286

SCHEMBL2591286

CC(C)(C)OC(=O)c1cccc2c(C=NOCl)cccc12

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.34
MAPT P10636 3/20 0.34
MEN1 O00255 3/20 0.34
AR P10275 2/20 0.32
KDM4E B2RXH2 2/20 0.32
NPSR1 Q6W5P4 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
RAB9A P51151 3/20 0.32
NPC1 O15118 2/20 0.32
RECQL P46063 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
GABRP O00591 1/20 0.31
GABRD O14764 1/20 0.31
GABRA1 P14867 1/20 0.31
GABRB1 P18505 1/20 0.31
GABRG2 P18507 1/20 0.31
GABRB3 P28472 1/20 0.31
GABRA5 P31644 1/20 0.31
GABRA3 P34903 1/20 0.31
GABRA2 P47869 1/20 0.31

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
SCHEMBL1937149 0.85 ALOX12 (0.41) KMT2AMAPTMEN1ARKDM4E
SCHEMBL2592464 0.85 ALOX12 (0.41) KMT2AMAPTMEN1ARKDM4E
SCHEMBL12157106 0.85 ALOX12 (0.41) KMT2AMAPTMEN1ARKDM4E
SCHEMBL1935692 0.80 PIM1 (0.39) KMT2AMAPTMEN1ARRAB9A
SCHEMBL14627192 0.80 AR (0.41) KMT2AMEN1ARRAB9ANPC1
SCHEMBL22531360 0.74 NR4A1 (0.48) KMT2AMEN1ARKDM4ERAB9A
SCHEMBL22545512 0.74 KDM4E (0.41) KMT2AMAPTMEN1ARKDM4E
SCHEMBL29471973 0.74 NR4A1 (0.48) KMT2AMEN1ARKDM4ERAB9A
SCHEMBL1415184 0.73 GABRP (0.44) KMT2AMEN1RAB9ANPC1GABRP
SCHEMBL4115038 0.72 CYP1A2 (0.45) KMT2AMEN1ARKDM4EGABRP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9216973-B2 Insecticidal compounds SYNGENTA PARTICIPATIONS AG (CH) 2015-12-22 US disclosed
EP-2331536-B1 INSECTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2013-08-21 EP disclosed
US-20130165485-A1 INSECTICIDAL COMPOUNDS SYNGENTA CROP PROTECTION LLC (US) 2013-06-27 US disclosed
US-20110269804-A1 INSECTICIDAL COMPOUNDS SYNGENTA CROP PROTECTION LLC (US) 2011-11-03 US 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 (2 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-20130165485-A1 INSECTICIDAL COMPOUNDS CHRM1, CHRM2, CHRM5 KMT2A 3701/4885MAPT 3793/4885MEN1 931/4885
US-20110269804-A1 INSECTICIDAL COMPOUNDS CHRM1, CHRM2, C1R KMT2A 3461/4885MAPT 4058/4885MEN1 769/4885

“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.