SCHEMBL7749565

SCHEMBL7749565

COC=C(Oc1cccc(COc2ccc(C)cc2)c1C(=O)OC(C)(C)C)C(=O)OC

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 8/20 0.38
NR1H3 Q13133 7/20 0.38
RXRA P19793 6/20 0.38
NPC1 O15118 1/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
FFAR1 O14842 2/20 0.35
FFAR4 Q5NUL3 2/20 0.35
MAPT P10636 1/20 0.34
HTT P42858 1/20 0.34
TP53 P04637 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
HIF1A Q16665 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
SCHEMBL7749562 1.00 NR1H2 (0.38) NR1H2NR1H3RXRANPC1MEN1
SCHEMBL7749531 0.93 NR1H2 (0.38) NR1H2NR1H3RXRANPC1KMT2A
SCHEMBL7749529 0.93 NR1H2 (0.38) NR1H2NR1H3RXRANPC1KMT2A
SCHEMBL7754457 0.92 NR1H2 (0.39) NR1H2NR1H3RXRAFFAR1SMN1; SMN2
SCHEMBL7754455 0.92 NR1H2 (0.39) NR1H2NR1H3RXRAFFAR1SMN1; SMN2
SCHEMBL7749510 0.91 KDM4E (0.37) NR1H2NR1H3RXRANPC1FFAR1
SCHEMBL7749507 0.91 KDM4E (0.37) NR1H2NR1H3RXRANPC1FFAR1
SCHEMBL7755669 0.90 NR1H2 (0.36) NR1H2NR1H3RXRA
SCHEMBL7755672 0.90 NR1H2 (0.36) NR1H2NR1H3RXRA
SCHEMBL7753580 0.87 FFAR1 (0.40) NPC1MEN1KMT2AFFAR1FFAR4

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-20010029239-A1 New herbicidal compositions CRAMP MICHAEL COLIN (GB) 2001-10-11 US disclosed
WO-2001047863-A2 NEW HERBICIDAL COMPOSITIONS AVENTIS CROPSCIENCE SA (FR) 2001-07-05 WO 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-20010029239-A1 New herbicidal compositions DDT, CYP1B1, CYP4X1 NR1H2 1849/4885NR1H3 2372/4885RXRA 412/4885

“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.