SCHEMBL7228060

SCHEMBL7228060

Cn1c(C(F)(F)F)cc(=O)n(-c2cc(Oc3ccc(OCc4ccccc4)cc3)c([N+](=O)[O-])cc2F)c1=O

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
ATM Q13315 1/20 0.42
PTGES O14684 3/20 0.39
AR P10275 1/20 0.38
MAPT P10636 3/20 0.38
TRIM24 O15164 1/20 0.37
BCAT2 O15382 1/20 0.36
BCAT1 P54687 1/20 0.36
LTA4H P09960 1/20 0.35
PTGS1 P23219 1/20 0.35
PTGS2 P35354 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
PKM P14618 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
CTSV O60911 1/20 0.35
CTSL P07711 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
SCHEMBL7234402 0.94 TRIM24 (0.40) MEN1KMT2ANPC1RAB9AATM
SCHEMBL1527273 0.91 HTR1A (0.37) MEN1KMT2APTGESMAPTBCAT2
SCHEMBL7237202 0.86 TRIM24 (0.39) MEN1KMT2ANPC1RAB9ATRIM24
SCHEMBL7228151 0.86 GAA (0.39) MEN1KMT2ANPC1RAB9AATM
SCHEMBL6638566 0.86 CYP11B1 (0.35) MEN1KMT2ANPC1RAB9AATM
SCHEMBL3261623 0.84 CTSV (0.35) MEN1KMT2ANPC1RAB9AATM
SCHEMBL14639555 0.83 BCAT1 (0.36) MEN1KMT2AMAPTBCAT2BCAT1
SCHEMBL6243873 0.82 SMN1; SMN2 (0.36) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL3248247 0.82 ALDH1A1 (0.37) MEN1KMT2AATMMAPTBCAT2
SCHEMBL27044946 0.80 ALDH1A1 (0.37) MEN1KMT2AATMMAPTBCAT2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6667413-B2 Aniline derivatives; herbicides; nonphytotoxic SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-12-23 US disclosed
US-20030130124-A1 Herbicides SUMITOMO CHEMICAL COMPANY, LIMITED 2003-07-10 US disclosed
US-6451740-B2 HERBICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-09-17 US disclosed
US-20020013466-A1 Uracil compounds and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-01-31 US disclosed
EP-1106607-A2 Uracil compounds and their use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-06-13 EP 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-20030130124-A1 Herbicides CBR3, CBR1, MT-CO1 MEN1 3863/4885KMT2A 1323/4885NPC1 3587/4885
US-20020013466-A1 Uracil compounds and use thereof UNG, MRM1, OGG1 MEN1 2823/4885KMT2A 2006/4885NPC1 2058/4885

“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.