SCHEMBL5147202

SCHEMBL5147202

CC(CCc1ccc(N)nc1)NCc1cccc(Cl)c1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
NOS1 P29475 3/20 0.44
NOS3 P29474 1/20 0.44
ATM Q13315 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
POLB P06746 1/20 0.43
KCNH2 Q12809 3/20 0.43
TMEM97 Q5BJF2 3/20 0.43
BCHE P06276 1/20 0.43
MASP2 O00187 1/20 0.42
TP53 P04637 1/20 0.41
PNMT P11086 1/20 0.40
SLC2A1 P11166 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
SCHEMBL6469030 0.86 KCNH2 (0.56) MEN1KMT2AATML3MBTL1POLB
SCHEMBL6471056 0.86 NOS1 (0.46) MEN1KMT2ANOS1NOS3L3MBTL1
SCHEMBL5131617 0.85 BCHE (0.58) MEN1KMT2AATML3MBTL1KCNH2
SCHEMBL6470305 0.83 ATM (0.47) MEN1KMT2AATML3MBTL1POLB
SCHEMBL6468962 0.83 TMEM97 (0.48) MEN1KMT2AKCNH2TMEM97BCHE
SCHEMBL6471113 0.79 TMEM97 (0.44) MEN1KMT2AATML3MBTL1POLB
SCHEMBL14731894 0.79 POLB (0.67) MEN1KMT2AATML3MBTL1POLB
SCHEMBL6468992 0.77 MEN1 (0.58) MEN1KMT2AATML3MBTL1POLB
SCHEMBL5133519 0.76 CPB2 (0.40) MEN1KMT2ANOS3KCNH2BCHE
SCHEMBL6469203 0.76 BCHE (0.41) MEN1KMT2AATML3MBTL1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050107381-A1 6-membered heteroaryl compounds for the treatment of neurodegenerative disorders PFIZER, INC. 2005-05-19 US claimed
EP-1654260-A4 6-MENBERED HETEROARYL COMPOUNDS FOR THE TREATMENT OF NEURODEGENERATIVE DISORDERS PFIZER PROD INC (US) 2008-09-24 EP disclosed
EP-1654260-A2 6-MENBERED HETEROARYL COMPOUNDS FOR THE TREATMENT OF NEURODEGENERATIVE DISORDERS Pfizer Products Inc. (US) 2006-05-10 EP disclosed
US-20050107381-A1 6-membered heteroaryl compounds for the treatment of neurodegenerative disorders PFIZER, INC. 2005-05-19 US disclosed
WO-2005011601-A2 6-MENBERED HETEROARYL COMPOUNDS FOR THE TREATMENT OF NEURODEGENERATIVE DISORDERS PFIZER PRODUCTS, INC. (US) 2005-02-10 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-20050107381-A1 6-membered heteroaryl compounds for the treatment of neurodegenerative disorders APP, BACE1, SNCA MEN1 978/4885KMT2A 2085/4885NOS1 1426/4885

“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.