SCHEMBL6149475

SCHEMBL6149475

CCOC(=O)C1(CCCc2c(Cl)cnc3cc(OC)c(OC)cc23)CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 11/20 0.41
MEN1 O00255 7/20 0.39
KMT2A Q03164 7/20 0.39
POLB P06746 2/20 0.39
LMNA P02545 2/20 0.39
PGK1 P00558 1/20 0.39
EPHA2 P29317 3/20 0.38
EPHB4 P54760 3/20 0.38
KDR P35968 2/20 0.38
KDM4E B2RXH2 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
P4HB P07237 1/20 0.38
ERBB2 P04626 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
SCHEMBL5706826 0.91 TLR9 (0.40) PGK1EPHA2EPHB4KDRERBB2
SCHEMBL448339 0.89 ALDH1A1 (0.42) ALDH1A1MEN1KMT2APOLBLMNA
SCHEMBL6147587 0.81 SLC2A1 (0.48) ALDH1A1MEN1KMT2APOLBLMNA
SCHEMBL5706799 0.80 SLC2A1 (0.44)
SCHEMBL6145300 0.79 KCNH2 (0.45) ALDH1A1MEN1KMT2APOLB
SCHEMBL6148079 0.76 KCNH2 (0.44) ALDH1A1MEN1KMT2APOLBP4HB
SCHEMBL6145673 0.76 ALDH1A1 (0.49) ALDH1A1MEN1KMT2APOLBLMNA
SCHEMBL6147144 0.75 ALDH1A1 (0.41) ALDH1A1MEN1KMT2APOLBLMNA
SCHEMBL6145877 0.75 SLC2A1 (0.42)
SCHEMBL6143468 0.73 MEN1 (0.46) ALDH1A1MEN1KMT2APOLBP4HB

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 ALDH1A1 838/4885MEN1 250/4885KMT2A 4202/4885
US-20020111492-A1 Heterocyclylalkylpiperidine derivatives, their preparation and compositions containing them SYNJ1, NCAPD2, SYNJ2 ALDH1A1 838/4885MEN1 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.