SCHEMBL5014389

SCHEMBL5014389

NOCc1cccc2nccnc12

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.44
KDM4E B2RXH2 1/20 0.44
MEN1 O00255 1/20 0.44
USP2 O75604 1/20 0.44
ALDH1A1 P00352 1/20 0.44
POLB P06746 1/20 0.44
KMT2A Q03164 1/20 0.44
IDO1 P14902 17/20 0.43
MAPK8 P45983 1/20 0.36
MAPK9 P45984 1/20 0.36
MAPK10 P53779 1/20 0.36

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
SCHEMBL25846851 0.79 LOXL2 (0.52) MAPTKDM4EMEN1USP2ALDH1A1
SCHEMBL5459975 0.78 MAPT (0.48) MAPTKDM4EMEN1ALDH1A1KMT2A
SCHEMBL5017627 0.78 MAPT (0.48) MAPTKDM4EMEN1POLBKMT2A
SCHEMBL14075492 0.77 MAPT (0.41) MAPTKDM4EMEN1USP2ALDH1A1
SCHEMBL7119359 0.75 ALDH1A1 (0.48) MAPTKDM4EMEN1USP2ALDH1A1
SCHEMBL2340487 0.75 MAPT (0.48) MAPTKDM4EMEN1USP2ALDH1A1
SCHEMBL8596016 0.75 MAPT (0.48) MAPTKDM4EMEN1USP2ALDH1A1
SCHEMBL30002633 0.75 MAPT (0.48) MAPTKDM4EMEN1USP2ALDH1A1
SCHEMBL3820241 0.75 MAPT (0.48) MAPTKDM4EMEN1USP2ALDH1A1
SCHEMBL18617684 0.75 MAPT (0.48) MAPTKDM4EMEN1USP2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7419962-B2 3,6-bicyclolides ENANTA PHARMACEUTICALS, INC. (US) 2008-09-02 US disclosed
US-20060142214-A1 3,6-bicyclolides ENANTA PHARMACEUTICALS, INC. 2006-06-29 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-20060142214-A1 3,6-bicyclolides ABCB11, CYP2B6, CYP3A7 MAPT 3856/4885KDM4E 2778/4885MEN1 3212/4885

“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.