SCHEMBL3321947

SCHEMBL3321947

O=C1C(=Cc2cccc(OCc3ccccc3)c2)COc2ccc(F)cc21

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAOB P27338 11/20 0.56
MAOA P21397 7/20 0.56
BCHE P06276 3/20 0.56
ACHE P22303 3/20 0.56
APP P05067 2/20 0.54
PPARG P37231 1/20 0.51
MEN1 O00255 1/20 0.50
NPC1 O15118 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP2C9 P11712 1/20 0.50
PKM P14618 1/20 0.50
CYP2C19 P33261 1/20 0.50
RAB9A P51151 1/20 0.50
KMT2A Q03164 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
HSD17B10 Q99714 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
SCHEMBL3321946 1.00 MAOB (0.56) MAOBMAOABCHEACHEAPP
SCHEMBL3318179 0.82 MAOB (0.71) MAOBMAOAACHEAPPMEN1
SCHEMBL3318182 0.82 MAOB (0.71) MAOBMAOAACHEAPPMEN1
SCHEMBL9661085 0.82 MAOB (0.50) MAOBMAOABCHEACHEAPP
SCHEMBL9661080 0.82 MAOB (0.50) MAOBMAOABCHEACHEAPP
SCHEMBL8465620 0.79 MAOB (0.49) MAOBMAOABCHEACHEAPP
SCHEMBL8465615 0.79 MAOB (0.49) MAOBMAOABCHEACHEAPP
SCHEMBL13397516 0.77 APP (0.55) MAOBMAOABCHEACHEAPP
SCHEMBL8034966 0.76 MAOB (0.57) MAOBMAOAMEN1NPC1CYP1A2
SCHEMBL8034968 0.76 MAOB (0.57) MAOBMAOAMEN1NPC1CYP1A2

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
US-20100104659-A1 BENZOPYRANOPYRAZOLES 4SC AG (DE) 2010-04-29 US disclosed
EP-2041141-A2 BENZOPYRANOPYRAZOLES 4SC AG (DE) 2009-04-01 EP disclosed
WO-2008006883-A2 BENZOPYRANOPYRAZOLES 4SC AG (DE) 2008-01-17 WO 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-20100104659-A1 BENZOPYRANOPYRAZOLES BAX, BCL2, BAD MAOB 3517/4885MAOA 3762/4885BCHE 2792/4885

“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.