SCHEMBL12420658

SCHEMBL12420658

Fc1cccc(COc2ccc(OCC3CCNCC3)cc2)c1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAOB P27338 8/20 0.56
HTR6 P50406 3/20 0.54
KCNH2 Q12809 4/20 0.53
SLC6A2 P23975 2/20 0.53
SLC6A4 P31645 2/20 0.53
HTR3A P46098 1/20 0.53
TDP1 Q9NUW8 1/20 0.52
NR4A2 P43354 1/20 0.51
PARP10 Q53GL7 1/20 0.50
SLC6A3 Q01959 1/20 0.50
SCN3A Q9NY46 2/20 0.48

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
SCHEMBL12420566 0.88 MAOB (0.58) MAOBHTR6KCNH2NR4A2PARP10
Hydrochloric Acid SCHEMBL2194424 0.87 MAOB (0.59) MAOBHTR6KCNH2NR4A2PARP10
SCHEMBL12420653 0.85 MAOB (0.51) MAOBHTR6KCNH2SLC6A2SLC6A4
SCHEMBL1532769 0.84 MAOB (0.59) MAOBHTR6KCNH2NR4A2PARP10
SCHEMBL1476345 0.83 SLC6A2 (0.61) HTR6KCNH2SLC6A2SLC6A4HTR3A
Hydrochloric Acid SCHEMBL2192010 0.83 MAOB (0.60) MAOBHTR6KCNH2NR4A2PARP10
Hydrochloric Acid SCHEMBL1474997 0.82 SLC6A2 (0.60) HTR6KCNH2SLC6A2SLC6A4HTR3A
SCHEMBL12735859 0.82 MAOB (0.50) MAOBHTR6KCNH2NR4A2PARP10
SCHEMBL1532864 0.81 MAOB (0.52) MAOBHTR6KCNH2SLC6A2SLC6A4
Hydrochloric Acid SCHEMBL1532794 0.81 MAOB (0.51) MAOBHTR6KCNH2NR4A2PARP10

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 MAOB 222/4885HTR6 3435/4885KCNH2 640/4885

“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.