SCHEMBL12844720

SCHEMBL12844720

CNC(=O)C(C)c1ccc(I)nc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR2 O15552 2/20 0.39
KMT2A Q03164 2/20 0.38
CDK2 P24941 2/20 0.37
GPR88 Q9GZN0 1/20 0.36
MAPK1 P28482 1/20 0.36
POLB P06746 1/20 0.36
RAB9A P51151 2/20 0.35
CHRM1 P11229 1/20 0.35
PDE4A P27815 1/20 0.35
CYP4F2 P78329 1/20 0.34
CYP4A11 Q02928 1/20 0.34
MAPT P10636 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
GAA P10253 1/20 0.33
CRHBP P24387 1/20 0.33
CRHR2 Q13324 1/20 0.33
ACACB O00763 1/20 0.33
NPC1 O15118 1/20 0.33
LMNA P02545 1/20 0.33
RIOK2 Q9BVS4 1/20 0.33

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
SCHEMBL12844876 0.80
SCHEMBL12844717 0.80 HPGD (0.41) KMT2AGPR88
SCHEMBL1747771 0.80 FFAR2 (0.46) FFAR2KMT2AMAPK1RAB9AMAPT
SCHEMBL24491000 0.72 UGT2B7 (0.36) SMN1; SMN2LMNA
SCHEMBL12979869 0.72 NPC1 (0.38) KMT2ARAB9AMAPTSMN1; SMN2NPC1
SCHEMBL27592790 0.71 RAB9A (0.51) FFAR2KMT2APOLBRAB9ASMN1; SMN2
SCHEMBL23453428 0.71 MAPT (0.57) FFAR2KMT2ARAB9ACHRM1PDE4A
Hydrochloric Acid SCHEMBL27749671 0.70 RAB9A (0.50) FFAR2KMT2APOLBRAB9ASMN1; SMN2
SCHEMBL2720269 0.69 CYP1A2 (0.50) FFAR2KMT2APOLBRAB9ACHRM1
SCHEMBL13448758 0.69 GRM7 (0.54) FFAR2KMT2ACHRM1PDE4AMAPT

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-7902233-B2 Compounds useful as pesticides DOW AGROSCIENCES LLC (US) 2011-03-08 US disclosed
US-20090318466-A1 COMPOUNDS USEFUL AS PESTICIDES DOW AGROSCIENCES LLC (US) 2009-12-24 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 (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-20090318466-A1 COMPOUNDS USEFUL AS PESTICIDES DDT, ACHE, BCHE FFAR2 4570/4885KMT2A 1969/4885CDK2 4200/4885

“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.