SCHEMBL12420566

SCHEMBL12420566

Fc1cccc(COc2ccc(CC3CCNCC3)cc2)c1

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOB P27338 11/20 0.58
HTR6 P50406 2/20 0.53
GBA1 P04062 1/20 0.51
NR4A2 P43354 1/20 0.50
MAOA P21397 2/20 0.49
KCNH2 Q12809 1/20 0.49
PARP10 Q53GL7 1/20 0.49

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
Hydrochloric Acid SCHEMBL2194424 0.99 MAOB (0.59) MAOBHTR6GBA1NR4A2MAOA
SCHEMBL12420658 0.88 MAOB (0.56) MAOBHTR6NR4A2KCNH2PARP10
SCHEMBL3966432 0.83 GBA1 (0.62) HTR6GBA1
SCHEMBL1532769 0.83 MAOB (0.59) MAOBHTR6NR4A2KCNH2PARP10
Hydrochloric Acid SCHEMBL2192010 0.82 MAOB (0.60) MAOBHTR6NR4A2KCNH2PARP10
Hydrochloric Acid SCHEMBL4777854 0.82 GBA1 (0.61) HTR6GBA1
Hydrochloric Acid SCHEMBL30522822 0.82 GBA1 (0.61) HTR6GBA1
SCHEMBL6929938 0.82 SLC6A4 (0.52) HTR6GBA1KCNH2
SCHEMBL12735859 0.81 MAOB (0.50) MAOBHTR6NR4A2MAOAKCNH2
SCHEMBL1532864 0.80 MAOB (0.52) MAOBHTR6NR4A2MAOAKCNH2

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 3435/4885GBA1 591/4885

“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.