SCHEMBL5497728

SCHEMBL5497728

Brc1c(OCc2ccccc2)ccc2occc12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 8/20 0.51
▸ MAOA P21397 7/20 0.51
▸ MAPK14 Q16539 1/20 0.43
▸ KCNA3 P22001 1/20 0.41
▸ LRRK2 Q5S007 1/20 0.41
▸ MAPT P10636 2/20 0.40
▸ L3MBTL1 Q9Y468 2/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ USP28 Q96RU2 1/20 0.39
▸ USP25 Q9UHP3 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ RAB9A P51151 2/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ HTT P42858 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ NPC1 O15118 1/20 0.38

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
SCHEMBL5501147 0.82 MAPT (0.56) MAOBMAOAMAPK14KCNA3MAPT
SCHEMBL3372411 0.80 MAOB (0.64) MAOBMAOAMAPK14KCNA3MAPT
SCHEMBL6768284 0.78 MAOB (0.48) MAOBMAOAKCNA3MAPTL3MBTL1
SCHEMBL31632472 0.74 MAOB (0.51) MAOBMAOAMAPK14LMNAGAA
SCHEMBL5654886 0.74 RAB9A (0.60) MAPK14MAPTL3MBTL1MAPK1LMNA
SCHEMBL30822036 0.74 RAB9A (0.60) MAPK14MAPTL3MBTL1MAPK1LMNA
SCHEMBL21953183 0.73 TDP1 (0.64) MAOBMAPK14MAPTL3MBTL1MAPK1
SCHEMBL31091535 0.72 MAOB (0.50) MAOBMAOAKCNA3L3MBTL1MAPK1
SCHEMBL15349084 0.72 MAOB (0.50) MAOBMAOAKCNA3L3MBTL1MAPK1
SCHEMBL28918460 0.72 MAPK14 (0.50) MAOBMAPK14MAPTL3MBTL1MAPK1

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
EP-1791807-A1 THERAPEUTIC DIPHENYL ETHER LIGANDS Pfizer Products Incorporated (US) 2007-06-06 — — EP disclosed
WO-2006027684-A1 THERAPEUTIC DIPHENYL ETHER LIGANDS PFIZER PRODUCTS INC. (US) 2006-03-16 — — WO disclosed
US-20060058361-A1 Therapeutic diphenyl ether ligands PFIZER INC 2006-03-16 — — 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-20060058361-A1 Therapeutic diphenyl ether ligands HTR2B, HTR2C, HTR3B MAOB 35/4885MAOA 94/4885MAPK14 2496/4885

“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.

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