SCHEMBL4096690

SCHEMBL4096690

CC(C)(C)OC(=O)C1(Oc2ccccc2)C=CC=CC1N

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.34
NFKB1 P19838 1/20 0.30
NFKB2 Q00653 1/20 0.30
RELA Q04206 1/20 0.30
ABCB1 P08183 1/20 0.30
MEN1 O00255 1/20 0.30
NPC1 O15118 1/20 0.30
HTT P42858 1/20 0.30
RAB9A P51151 1/20 0.30
KMT2A Q03164 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
SCHEMBL2276486 0.76 RORC (0.33) KDM1ANFKB1NFKB2RELAABCB1
SCHEMBL2649896 0.69 CA4 (0.30)
SCHEMBL11652966 0.68 CA12 (0.36) ABCB1MEN1NPC1HTTRAB9A
SCHEMBL2268370 0.66 ELANE (0.46) KDM1A
SCHEMBL11673779 0.63 PARP10 (0.31)
SCHEMBL10433537 0.62 ABCB1 (0.37) KDM1ANFKB1NFKB2RELAABCB1
SCHEMBL5727679 0.62 RECQL (0.40) KDM1ANFKB1NFKB2RELAABCB1
SCHEMBL222445 0.61
Anisole SCHEMBL27782485 0.60 CA4 (0.54) NPC1HTTRAB9AKMT2A
SCHEMBL8954748 0.60 ALOX15 (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090240052-A1 NOVEL ANTHRANILIC ACID DERIVATIVE OR SALT THEREOF TOYAMA CHEMICAL CO., LTD. (JP) 2009-09-24 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-20090240052-A1 NOVEL ANTHRANILIC ACID DERIVATIVE OR SALT THEREOF MMP13, MMP26, MMP11 KDM1A 443/4885NFKB1 185/4885NFKB2 261/4885

“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.