SCHEMBL4804543

SCHEMBL4804543

COCCOCCOCc1cn(Cc2ccc(F)cc2F)c2cnc(C(=O)NO)cc12

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FSCN1 Q16658 1/20 0.39
PDE10A Q9Y233 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
HDAC1 Q13547 3/20 0.36
HDAC6 Q9UBN7 3/20 0.36
HDAC3 O15379 1/20 0.36
HDAC2 Q92769 1/20 0.36
PPARG P37231 5/20 0.35
PTGDR2 Q9Y5Y4 1/20 0.35
HDAC10 Q969S8 1/20 0.35
HDAC7 Q8WUI4 1/20 0.34
ALKBH1 Q13686 1/20 0.34
GRIN2B Q13224 1/20 0.34
MAPK14 Q16539 3/20 0.34
MET P08581 1/20 0.34

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
SCHEMBL4805488 0.99 FSCN1 (0.39) FSCN1PDE10AMEN1KMT2AHDAC1
SCHEMBL4803688 0.92 FSCN1 (0.39) FSCN1PDE10AMEN1KMT2APPARG
SCHEMBL4804162 0.91 FSCN1 (0.40) FSCN1PDE10AMEN1KMT2APPARG
SCHEMBL4805917 0.90 PTGER1 (0.40) FSCN1PDE10AMEN1KMT2APPARG
SCHEMBL2943244 0.90 FSCN1 (0.40) FSCN1PDE10AMEN1KMT2AHDAC1
SCHEMBL4804042 0.88 FSCN1 (0.37) FSCN1PDE10AMEN1KMT2APPARG
SCHEMBL2945177 0.87 HDAC1 (0.41) FSCN1MEN1KMT2AHDAC1HDAC6
SCHEMBL2943245 0.86 FSCN1 (0.42) FSCN1PDE10AHDAC1HDAC6HDAC3
SCHEMBL1684192 0.86 PPARG (0.41) FSCN1MEN1KMT2AHDAC1HDAC6
SCHEMBL4807252 0.84 MAPK14 (0.38) FSCN1MEN1KMT2AHDAC1HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7468375-B2 Inhibitors of the HIV integrase enzyme PFIZER INC. (US) 2008-12-23 US claimed
EP-1756103-A2 PYRROLOPYRIDINE DERIVATIVES AND THEIR USE AS HIV-INTEGRASE INHIBITORS Pfizer, Inc. (US) 2007-02-28 EP claimed
US-20050277662-A1 Inhibitors of the HIV integrase enzyme AGOURON PHARMACEUTICALS, INC 2005-12-15 US claimed
WO-2005103003-A2 PYRROLOPYRIDINE DERIVATIVES AND THEIR USE AS HIV-INTEGRASE INHIBITORS PFIZER INC. (US) 2005-11-03 WO claimed
US-7468375-B2 Inhibitors of the HIV integrase enzyme PFIZER INC. (US) 2008-12-23 US disclosed
US-7468375-B2 Inhibitors of the HIV integrase enzyme PFIZER INC. (US) 2008-12-23 US disclosed
EP-1756103-A2 PYRROLOPYRIDINE DERIVATIVES AND THEIR USE AS HIV-INTEGRASE INHIBITORS Pfizer, Inc. (US) 2007-02-28 EP disclosed
US-20050277662-A1 Inhibitors of the HIV integrase enzyme AGOURON PHARMACEUTICALS, INC 2005-12-15 US disclosed
WO-2005103003-A2 PYRROLOPYRIDINE DERIVATIVES AND THEIR USE AS HIV-INTEGRASE INHIBITORS PFIZER INC. (US) 2005-11-03 WO 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-20050277662-A1 Inhibitors of the HIV integrase enzyme IMPDH1, INTS9, TYMP FSCN1 4841/4885PDE10A 2565/4885MEN1 4787/4885

“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.