SCHEMBL12840806

SCHEMBL12840806

O=C(P)c1ccc(OCCCCCCCCCCCCOC2CCCCO2)cc1

nearest known ligand 0.80

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.80
KMT2A Q03164 1/20 0.80
HRH3 Q9Y5N1 2/20 0.43
KDM4C Q9H3R0 1/20 0.43
GAA P10253 1/20 0.42
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
GPR119 Q8TDV5 5/20 0.42
L3MBTL1 Q9Y468 1/20 0.40
TP53 P04637 1/20 0.39
TSHR P16473 1/20 0.39

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
SCHEMBL224651 0.89 MEN1 (1.00) MEN1KMT2AL3MBTL1TP53TSHR
SCHEMBL224471 0.89 MEN1 (1.00) MEN1KMT2AL3MBTL1TP53TSHR
SCHEMBL1531929 0.89 MEN1 (1.00) MEN1KMT2AL3MBTL1TP53TSHR
SCHEMBL15478773 0.88 MEN1 (0.80) MEN1KMT2AHRH3KDM4CGAA
SCHEMBL12768363 0.86 KMT2A (0.78) MEN1KMT2AHRH3KDM4CGAA
SCHEMBL1531938 0.86 KMT2A (0.78) MEN1KMT2AHRH3KDM4CGAA
SCHEMBL9335079 0.86 MEN1 (0.95) MEN1KMT2AHRH3L3MBTL1TP53
SCHEMBL12768508 0.85 MEN1 (0.76) MEN1KMT2AHRH3GAANPC1
SCHEMBL28597015 0.85 MEN1 (0.93) MEN1KMT2ATP53TSHR
SCHEMBL1531787 0.85 MEN1 (0.76) MEN1KMT2AHRH3GAANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2698412-A2 Mesogen containing compounds TRANSITIONS OPTICAL, INC. (US) 2014-02-19 EP disclosed
US-7910019-B2 Mesogen containing compounds TRANSITIONS OPTICAL, INC. (US) 2011-03-22 US disclosed
US-20090323011-A1 MESOGEN CONTAINING COMPOUNDS TRANSITIONS OPTICAL, INC. (US) 2009-12-31 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-20090323011-A1 MESOGEN CONTAINING COMPOUNDS MYOC, BMP2, RARG MEN1 117/4885KMT2A 3837/4885HRH3 3539/4885

“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.