SCHEMBL12420769

SCHEMBL12420769

O=C(c1cccc(OCC2CCCCC2)c1)N1CCNCC1

nearest known ligand 0.60

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 1/20 0.58
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
SIGMAR1 Q99720 1/20 0.48
KAT6A Q92794 1/20 0.47
RBP4 P02753 1/20 0.46
GAA P10253 1/20 0.46
HTT P42858 1/20 0.46
PARP1 P09874 1/20 0.46
ALDH1A1 P00352 1/20 0.46
PARP15 Q460N3 1/20 0.45
PARP10 Q53GL7 1/20 0.45

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
SCHEMBL18611678 0.90 MGLL (0.59) MGLLMEN1KMT2AKAT6AGAA
SCHEMBL12420768 0.89 MEN1 (0.47) MGLLMEN1KMT2ASIGMAR1GAA
Hydrochloric Acid SCHEMBL2196700 0.88 MEN1 (0.47) MGLLMEN1KMT2ASIGMAR1GAA
SCHEMBL12735911 0.85 PARP15 (0.59) MEN1KMT2ASIGMAR1RBP4ALDH1A1
SCHEMBL12735908 0.85 PARP15 (0.59) MEN1KMT2ASIGMAR1RBP4ALDH1A1
Hydrochloric Acid SCHEMBL1532819 0.84 PARP15 (0.58) MEN1KMT2ASIGMAR1RBP4ALDH1A1
SCHEMBL30170608 0.84 MGLL (0.52) MGLLMEN1KMT2AGAAHTT
SCHEMBL13806533 0.84 PARP15 (0.58) MEN1KMT2ASIGMAR1RBP4ALDH1A1
Hydrochloric Acid SCHEMBL30170667 0.83 MGLL (0.51) MGLLMEN1KMT2AGAAHTT
SCHEMBL15062224 0.82 PARP15 (0.55) MEN1KMT2ASIGMAR1RBP4ALDH1A1

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-20110172230-A1 UREA COMPOUND OR SALT THEREOF ASTELLAS PHARMA INC. (JP) 2011-07-14 US disclosed
US-20110172230-A1 UREA COMPOUND OR SALT THEREOF ASTELLAS PHARMA INC. (JP) 2011-07-14 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-20110172230-A1 UREA COMPOUND OR SALT THEREOF FAAH, FAAH2, UTS2R MGLL 263/4885MEN1 4707/4885KMT2A 1156/4885

“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.