SCHEMBL6148100

SCHEMBL6148100

COc1ccc2ncc(Cl)c(CCCC3(C(=O)OCc4ccccc4)CCN(CCC4CCCCC4)CC3)c2c1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 5/20 0.45
MEN1 O00255 6/20 0.42
KMT2A Q03164 6/20 0.42
POLB P06746 3/20 0.42
MAPT P10636 2/20 0.41
LMNA P02545 2/20 0.41
ALDH1A1 P00352 5/20 0.40
PKM P14618 2/20 0.40
OPRM1 P35372 1/20 0.40
OPRD1 P41143 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
MAPK1 P28482 1/20 0.39

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
SCHEMBL6144885 0.90 KCNH2 (0.52) KCNH2MEN1KMT2APOLBMAPT
SCHEMBL5706809 0.89 KCNH2 (0.43) KCNH2ALDH1A1
SCHEMBL6145477 0.89 KCNH2 (0.43) KCNH2ALDH1A1
SCHEMBL6145924 0.88 MEN1 (0.46) KCNH2MEN1KMT2APOLBMAPT
SCHEMBL6146970 0.85 KCNH2 (0.45) KCNH2MEN1KMT2APOLBMAPT
SCHEMBL6148626 0.85 KCNH2 (0.40) KCNH2
SCHEMBL6147564 0.85 KCNH2 (0.46) KCNH2MEN1KMT2APOLBMAPT
SCHEMBL6145478 0.85 KCNH2 (0.47) KCNH2MEN1KMT2APOLBMAPT
SCHEMBL6149007 0.84 KCNH2 (0.42) KCNH2
SCHEMBL6149086 0.84 KCNH2 (0.43) KCNH2

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-6903217-B2 Heterocyclylalkylpiperidine derivatives, their preparation and compositions containing them AVENTIS PHARMA S.A. (FR) 2005-06-07 US disclosed
US-20040147518-A1 Heterocyclylalkylpiperidine derivatives, their preparation and compositions containing them AVENTIS PHARMA S.A. 2004-07-29 US disclosed
US-6603005-B2 Bactericides AVENTIS PHARMA S.A. (FR) 2003-08-05 US disclosed
US-20020111492-A1 Heterocyclylalkylpiperidine derivatives, their preparation and compositions containing them NOVEXEL (FR) 2002-08-15 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 (2 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-20040147518-A1 Heterocyclylalkylpiperidine derivatives, their preparation and compositions containing them SYNJ1, NCAPD2, SYNJ2 KCNH2 81/4885MEN1 250/4885KMT2A 4202/4885
US-20020111492-A1 Heterocyclylalkylpiperidine derivatives, their preparation and compositions containing them SYNJ1, NCAPD2, SYNJ2 KCNH2 81/4885MEN1 250/4885KMT2A 4202/4885

“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.