SCHEMBL4345352

SCHEMBL4345352

C[Sn](C)(C)c1ccc(CON2C(=O)c3ccccc3C2=O)nc1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.44
HTT P42858 1/20 0.44
MEN1 O00255 4/20 0.43
KMT2A Q03164 4/20 0.43
MAPT P10636 3/20 0.43
GAA P10253 2/20 0.42
RECQL P46063 1/20 0.40
ATM Q13315 1/20 0.39
CYP1A2 P05177 2/20 0.38
CYP2C9 P11712 1/20 0.38
POLB P06746 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
PKM P14618 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.32
KDM4E B2RXH2 1/20 0.32
F2 P00734 1/20 0.32
VDR P11473 1/20 0.32

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
SCHEMBL15071827 0.82 MEN1 (0.47) ALDH1A1HTTMEN1KMT2AMAPT
SCHEMBL2935415 0.79 MEN1 (0.48) ALDH1A1HTTMEN1KMT2AMAPT
SCHEMBL13477401 0.79 KMT2A (0.47) ALDH1A1HTTMEN1KMT2AMAPT
SCHEMBL4347031 0.79 MEN1 (0.47) ALDH1A1HTTMEN1KMT2AMAPT
SCHEMBL13140630 0.76 MEN1 (0.43) ALDH1A1HTTMEN1KMT2AMAPT
SCHEMBL2219482 0.75 ALDH1A1 (0.58) ALDH1A1HTTMEN1KMT2AMAPT
SCHEMBL2937635 0.75 ALDH1A1 (0.46) ALDH1A1HTTMEN1KMT2AMAPT
SCHEMBL13140934 0.70 NAMPT (0.42) POLBKDM4E
SCHEMBL15493696 0.70 KDM4E (0.41) ALDH1A1HTTMEN1KMT2ACYP1A2
SCHEMBL17067450 0.70 ALDH1A1 (0.41) ALDH1A1HTTMEN1KMT2AMAPT

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-9242974-B2 Processes for the preparation of 2-fluoro 6-11 bicyclic erythromycin derivatives ENANTA PHARMACEUTICALS, INC. (US) 2016-01-26 US disclosed
US-20140073797-A1 PROCESSES FOR THE PREPARATION OF 2-FLUORO 6-11 BICYCLIC ERYTHROMYCIN DERIVATIVES ENANTA PHARMACEUTICALS, INC. (US) 2014-03-13 US disclosed
US-8552162-B2 Processes for the preparation of 2 fluoro 6-11 bicyclic erythromycin derivatives ENANTA PHARMACEUTICALS, INC. (US) 2013-10-08 US disclosed
WO-2009137787-A1 PROCESSES FOR THE PREPARATION OF 2-FLUORO 6-11 BICYCLIC ERYTHROMYCIN DERIVATIVES ENANTA PHARMACEUTICALS, INC. (US) 2009-11-12 WO disclosed
US-20090281293-A1 PROCESSES FOR THE PREPARATION OF 2 FLUORO 6-11 BICYCLIC ERYTHROMYCIN DERIVATIVES ENANTA PHARMACEUTICALS, INC. 2009-11-12 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-20140073797-A1 PROCESSES FOR THE PREPARATION OF 2-FLUORO 6-11 BICYCLIC ERYTHROMYCIN DERIVATIVES CYP2F1, CYP2B6, CYP4F11 ALDH1A1 4501/4885HTT 3074/4885MEN1 3620/4885
US-20090281293-A1 PROCESSES FOR THE PREPARATION OF 2 FLUORO 6-11 BICYCLIC ERYTHROMYCIN DERIVATIVES CYP2F1, CYP2B6, CYP4F11 ALDH1A1 4493/4885HTT 3227/4885MEN1 3593/4885

“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.