SCHEMBL3144052

SCHEMBL3144052

C[CH]c1ccc(-n2ccnc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.58
LMNA P02545 1/20 0.58
ENPP2 Q13822 1/20 0.58
MKNK1 Q9BUB5 1/20 0.58
MKNK2 Q9HBH9 1/20 0.58
NOTUM Q6P988 1/20 0.58
CYP3A4 P08684 4/20 0.57
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
ALOX15 P16050 1/20 0.55
TSHR P16473 1/20 0.55
BAZ2B Q9UIF8 1/20 0.54
MAOB P27338 3/20 0.51
KDM4E B2RXH2 1/20 0.51
MITF O75030 1/20 0.51
ALDH1A1 P00352 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
CYP19A1 P11511 2/20 0.50
CYP1A2 P05177 2/20 0.50
CYP2D6 P10635 2/20 0.50

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
SCHEMBL2532397 0.83 LMNA (0.78) MAPTLMNAENPP2MKNK1MKNK2
SCHEMBL8288350 0.82 MAPT (0.60) MAPTLMNAENPP2MKNK1MKNK2
SCHEMBL209879 0.82 MAPT (0.60) MAPTLMNAENPP2MKNK1MKNK2
Hydrochloric Acid SCHEMBL28701756 0.81 LMNA (0.75) MAPTLMNAENPP2MKNK1MKNK2
SCHEMBL28436213 0.81 MAPT (0.58) MAPTLMNAENPP2MKNK1MKNK2
SCHEMBL6847884 0.78 MAPT (0.55) MAPTLMNAENPP2MKNK1MKNK2
SCHEMBL22579260 0.78 MEN1 (0.66) MAPTLMNAENPP2MKNK1MKNK2
SCHEMBL28529168 0.78 MAPT (0.55) MAPTLMNAENPP2MKNK1MKNK2
SCHEMBL8392726 0.78 CYP3A4 (0.69) MAPTLMNAENPP2MKNK1MKNK2
SCHEMBL7295758 0.78 MAPT (0.55) MAPTLMNAENPP2MKNK1MKNK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2233493-A1 Macrolides Pfizer Products Inc. (US) 2010-09-29 EP disclosed
EP-1836211-B1 MACROLIDES PFIZER PROD INC (US) 2010-03-03 EP disclosed
US-7462600-B2 Macrolides PFIZER INC (US) 2008-12-09 US disclosed
CN-101120011-A Macrolides PFIZER PROD INC (US) 2008-02-06 CN disclosed
EP-1553949-B1 PYRIMIDINE-2,4-DIONE DERIVATIVES AS MATRIX METALLOPROTEINASE INHIBITORS WARNER LAMBERT CO (US) 2007-04-18 EP disclosed
US-7160893-B2 Pyrimidine-2,4-dione derivatives as matrix metalloproteinase inhibitors WARNER-LAMBERT COMPANY (US) 2007-01-09 US disclosed
US-20060135447-A1 Macrolides CHUPAK LOUIS S 2006-06-22 US disclosed
US-20040053952-A1 Pyrimidine-2,4-dione derivatives as matrix metalloproteinase inhibitors HICKS JAMES LESTER (US) 2004-03-18 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-20060135447-A1 Macrolides LCAT, NOP2, HDAC6 MAPT 1800/4885LMNA 660/4885ENPP2 715/4885
US-20040053952-A1 Pyrimidine-2,4-dione derivatives as matrix metalloproteinase inhibitors MMP1, MMP9, MMP13 MAPT 2145/4885LMNA 3796/4885ENPP2 700/4885

“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.