SCHEMBL3411073

SCHEMBL3411073

COC(=O)C=C1c2cc(OCc3ccccc3)ccc2CC1(C)C

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAOB P27338 10/20 0.46
MAOA P21397 7/20 0.46
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
ACACB O00763 1/20 0.42
HRH3 Q9Y5N1 1/20 0.41
ADAM17 P78536 1/20 0.41
TOP1 P11387 1/20 0.41
FFAR1 O14842 2/20 0.40
PPARG P37231 1/20 0.40
ALDH1A1 P00352 1/20 0.40

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
SCHEMBL3411068 1.00 MAOB (0.46) MAOBMAOANPC1RAB9ASMN1; SMN2
SCHEMBL3430302 0.90 MAOB (0.48) MAOBMAOAHRH3TOP1FFAR1
SCHEMBL3430304 0.90 MAOB (0.48) MAOBMAOAHRH3TOP1FFAR1
SCHEMBL13047892 0.80 MAOB (0.49) MAOBMAOANPC1RAB9ASMN1; SMN2
SCHEMBL3410838 0.79 MAOB (0.53) MAOBMAOANPC1RAB9ASMN1; SMN2
SCHEMBL3410834 0.79 MAOB (0.53) MAOBMAOANPC1RAB9ASMN1; SMN2
SCHEMBL3408642 0.78 MAOB (0.58) MAOBMAOAHRH3TOP1
SCHEMBL13048353 0.77 MAOB (0.49) MAOBMAOANPC1RAB9ASMN1; SMN2
SCHEMBL13048371 0.77 MAOB (0.49) MAOBMAOANPC1RAB9ASMN1; SMN2
SCHEMBL3404627 0.74 MAOB (0.53) MAOBMAOANPC1RAB9ASMN1; SMN2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8450522-B2 Conformationally constrained carboxylic acid derivatives useful for treating metabolic disorders AMGEN INC. (US) 2013-05-28 US disclosed
EP-2260017-A1 CONFORMATIONALLY CONSTRAINED CARBOXYLIC ACID DERIVATIVES USEFUL FOR TREATING METABOLIC DISORDERS Amgen, Inc (US) 2010-12-15 EP disclosed
US-20100298367-A1 Conformationally Constrained Carboxylic Acid Derivatives Useful for Treating Metabolic Disorders AMGEN INC. 2010-11-25 US disclosed
WO-2009111056-A1 CONFORMATIONALLY CONSTRAINED CARBOXYLIC ACID DERIVATIVES USEFUL FOR TREATING METABOLIC DISORDERS AMGEN INC. (US) 2009-09-11 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-20100298367-A1 Conformationally Constrained Carboxylic Acid Derivatives Useful for Treating Metabolic Disorders PC, GOT2, CS MAOB 926/4885MAOA 1014/4885NPC1 707/4885

“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.