SCHEMBL12420873

SCHEMBL12420873

Fc1cccc(COc2ccc(CN3CCNCC3)cc2)c1

nearest known ligand 0.60

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAOB P27338 12/20 0.60
MAOA P21397 5/20 0.55
HTR6 P50406 1/20 0.53
PRMT5 O14744 1/20 0.53
SIGMAR1 Q99720 1/20 0.51
SPHK2 Q9NRA0 1/20 0.51
SPHK1 Q9NYA1 1/20 0.51
NR4A2 P43354 1/20 0.50
HRH3 Q9Y5N1 1/20 0.50
NPC1 O15118 1/20 0.50
TP53 P04637 1/20 0.50
RAB9A P51151 1/20 0.50

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 SCHEMBL2198299 0.99 MAOB (0.59) MAOBMAOAHTR6PRMT5SIGMAR1
SCHEMBL21347499 0.88 HRH3 (0.66) MAOBMAOAHRH3
SCHEMBL2233922 0.85 HRH3 (0.64) MAOBSIGMAR1HRH3NPC1TP53
SCHEMBL14859644 0.84 SIGMAR1 (0.70) PRMT5SIGMAR1HRH3NPC1TP53
SCHEMBL608181 0.83 ALDH1A1 (0.70) SIGMAR1
SCHEMBL29566534 0.83 ALDH1A1 (0.70) SIGMAR1
SCHEMBL2193907 0.83 MAOB (0.56) MAOBMAOAHTR6PRMT5NR4A2
Hydrochloric Acid SCHEMBL2924548 0.82 ALDH1A1 (0.68) SIGMAR1
Hydrochloric Acid SCHEMBL7426019 0.82 ALDH1A1 (0.68) SIGMAR1
SCHEMBL12420762 0.81 NR4A2 (0.55) MAOBMAOAPRMT5NR4A2

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 222/4885MAOA 309/4885HTR6 3435/4885

“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.