SCHEMBL2835883

SCHEMBL2835883

C=CCn1nnc(-c2cc(-n3c(=O)cc(C(F)(F)F)n(C)c3=O)ccc2Cl)n1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.32
HPGD P15428 1/20 0.32
RAB9A P51151 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
BRD9 Q9H8M2 1/20 0.30

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
SCHEMBL2834363 0.89 BRD9 (0.34) NPC1HPGDRAB9AL3MBTL1BRD9
SCHEMBL2834947 0.86 DDX3X (0.36) NPC1HPGDRAB9AL3MBTL1BRD9
SCHEMBL2841614 0.86 KDM4E (0.32) NPC1HPGDRAB9AL3MBTL1BRD9
SCHEMBL2837070 0.85 ESR1 (0.40) NPC1HPGDRAB9AL3MBTL1
SCHEMBL2834359 0.85 NPC1 (0.39) NPC1HPGDRAB9AL3MBTL1
SCHEMBL2833844 0.85 NPC1 (0.39) NPC1HPGDRAB9AL3MBTL1
SCHEMBL2836109 0.85 KMT2A (0.40) NPC1HPGDRAB9ABRD9
SCHEMBL2842393 0.85 XPO1 (0.32) NPC1HPGDRAB9AL3MBTL1BRD9
SCHEMBL1573784 0.85 NPC1 (0.39) NPC1HPGDRAB9AL3MBTL1
SCHEMBL2836987 0.85 CNR1 (0.35) NPC1HPGDRAB9AL3MBTL1

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-7754880-B2 Uracils having a herbicidal activity ISAGRO RICERCA S.R.L. (IT) 2010-07-13 US claimed
US-20060025591-A1 New uracils having a herbicidal activity ISEM S.R.L. (IT) 2006-02-02 US claimed
US-7754880-B2 Uracils having a herbicidal activity ISAGRO RICERCA S.R.L. (IT) 2010-07-13 US disclosed
US-20060025591-A1 New uracils having a herbicidal activity ISEM S.R.L. (IT) 2006-02-02 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-20060025591-A1 New uracils having a herbicidal activity UNG, DDT, UMPS NPC1 4643/4885HPGD 2001/4885RAB9A 2151/4885

“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.