SCHEMBL4869849

SCHEMBL4869849

Cc1ccc(-n2cc(-c3cscn3)nc2-c2ccc(I)cc2)cn1

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 3/20 0.38
PTGS2 P35354 6/20 0.36
METAP2 P50579 1/20 0.34
METAP1 P53582 1/20 0.34
GRK5 P34947 1/20 0.32
PDE10A Q9Y233 4/20 0.31

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
SCHEMBL4853177 0.83 PTGS1 (0.38) PTGS1PTGS2PDE10A
SCHEMBL4807681 0.82 CYP3A4 (0.39) PTGS1PTGS2PDE10A
SCHEMBL4854572 0.81 PTGS1 (0.33) PTGS1PTGS2METAP2METAP1GRK5
SCHEMBL4808161 0.80 PTGS1 (0.39) PTGS1PTGS2METAP1PDE10A
SCHEMBL4868735 0.79 PTGS1 (0.39) PTGS1PTGS2PDE10A
SCHEMBL4860628 0.79 KDM4E (0.38) PTGS1PTGS2PDE10A
SCHEMBL14194760 0.78 PDE10A (0.39) PTGS1PTGS2METAP2METAP1GRK5
SCHEMBL4856160 0.76 PDE10A (0.46) METAP2METAP1GRK5PDE10A
SCHEMBL4873094 0.76 PDE4B (0.37) PTGS1PTGS2METAP2METAP1GRK5
SCHEMBL4810368 0.76 PDE4B (0.36) METAP2METAP1GRK5PDE10A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080090834-A1 SELECTIVE AZOLE PDE10A INHIBITOR COMPOUNDS PFIZER INC 2008-04-17 US disclosed
US-20080090834-A1 SELECTIVE AZOLE PDE10A INHIBITOR COMPOUNDS PFIZER INC 2008-04-17 US disclosed
US-20080090834-A1 SELECTIVE AZOLE PDE10A INHIBITOR COMPOUNDS PFIZER INC 2008-04-17 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-20080090834-A1 SELECTIVE AZOLE PDE10A INHIBITOR COMPOUNDS PDE5A, PDE3B, PDE12 PTGS1 527/4885PTGS2 854/4885METAP2 2524/4885

“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.