SCHEMBL6044342

SCHEMBL6044342

COCCCOc1cc(Br)ccc1C(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.46
HTT P42858 3/20 0.46
MAPK1 P28482 1/20 0.46
PTGDR2 Q9Y5Y4 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.42
KDM4E B2RXH2 9/20 0.41
KMT2A Q03164 3/20 0.41
RAB9A P51151 3/20 0.39
NPC1 O15118 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
ALDH1A1 P00352 4/20 0.35
MEN1 O00255 2/20 0.35
HPGD P15428 1/20 0.35
USP2 O75604 1/20 0.35

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
SCHEMBL4640186 0.88 KDM4E (0.40) LMNAHTTMAPK1PTGDR2L3MBTL1
SCHEMBL89647 0.86 S1PR4 (0.41) LMNAHTTMAPK1L3MBTL1KDM4E
SCHEMBL1911365 0.80 KDM4E (0.43) LMNAMAPK1L3MBTL1KDM4EKMT2A
SCHEMBL18758863 0.80 PTGDR2 (0.47) LMNAHTTMAPK1PTGDR2L3MBTL1
SCHEMBL89109 0.79 HTT (0.45) LMNAHTTMAPK1L3MBTL1KDM4E
SCHEMBL17893778 0.78 L3MBTL1 (0.53) LMNAMAPK1L3MBTL1KDM4EKMT2A
SCHEMBL29521181 0.78 MAPT (0.50) LMNAMAPK1L3MBTL1KDM4EKMT2A
SCHEMBL842107 0.78 MAPT (0.50) LMNAMAPK1L3MBTL1KDM4EKMT2A
SCHEMBL429553 0.78 KDM4E (0.50) LMNAMAPK1L3MBTL1KDM4EKMT2A
SCHEMBL25042047 0.77 HTT (0.46) LMNAHTTMAPK1L3MBTL1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060154926-A1 Methods of treating alzheimer's disease using aryl alkanoic acid amides ELAN PHARMACEUTICALS, INC. 2006-07-13 US disclosed
WO-2003103653-A1 METHODS OF TREATING ALZHEIMER'S DISEASE USING ARYL ALKANOIC ACID AMIDES ELAN PHARMACEUTICALS, INC. (US) 2003-12-18 WO disclosed
US-5705658-A HYPOTENSIVE AGENTS NOVARTIS CORPORATION (US) 1998-01-06 US disclosed
US-5654445-A INTERMEDIATES FOR RENIN INHIBITORS, HYPOTENSIVE AGENTS CIBA-GEIGY CORPORATION (US) 1997-08-05 US disclosed
US-5646143-A FOR TREATING A VARIETY OF CONDITIONS CIBA-GEIGY CORPORATION (US) 1997-07-08 US disclosed
US-5627182-A RENIN INHIBITORS FOR USE AS HYPOTENSIVE AGENTS CIBA GEIGY CORPORATION (US) 1997-05-06 US disclosed
US-5559111-A HYPOTENSIVE AGENTS; RENIN INHIBITORS; Aliskiren CIBA-GEIGY CORPORATION (US) 1996-09-24 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-20060154926-A1 Methods of treating alzheimer's disease using aryl alkanoic acid amides BACE1, APP, PSEN1 LMNA 2080/4885HTT 133/4885MAPK1 3285/4885

“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.