SCHEMBL4858244

SCHEMBL4858244

Cc1cc(C(=O)/C(=N/O)c2cnccn2)ccc1-n1ccc2cccnc21

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SLC22A12 Q96S37 10/20 0.41
SLC22A6 Q4U2R8 1/20 0.34
ABCG2 Q9UNQ0 1/20 0.34
ALDH1A1 P00352 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
HPGD P15428 1/20 0.33
KDM4E B2RXH2 1/20 0.33
RAPGEF4 Q8WZA2 1/20 0.33
PARP1 P09874 1/20 0.33
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 0.32
CASP3 P42574 1/20 0.32
SENP8 Q96LD8 1/20 0.32
SENP7 Q9BQF6 1/20 0.32
SENP6 Q9GZR1 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
SCHEMBL4858249 1.00 SLC22A12 (0.41) SLC22A12SLC22A6ABCG2ALDH1A1SMN1; SMN2
SCHEMBL4854578 0.84 SLC22A12 (0.38) SLC22A12SLC22A6ABCG2SMN1; SMN2HPGD
SCHEMBL8228696 0.84 SLC22A12 (0.38) SLC22A12SLC22A6ABCG2SMN1; SMN2HPGD
SCHEMBL4854568 0.84 SLC22A12 (0.38) SLC22A12SLC22A6ABCG2SMN1; SMN2HPGD
SCHEMBL4878389 0.78 SLC22A12 (0.43) SLC22A12SLC22A6ABCG2HPGDKDM4E
SCHEMBL28441844 0.77 SLC22A12 (0.53) SLC22A12SLC22A6ABCG2RAPGEF4PARP1
SCHEMBL4809049 0.74 ALOX15 (0.52) SLC22A12SMN1; SMN2HPGDKDM4ERAPGEF4
SCHEMBL4874200 0.72 SLC22A12 (0.39) SLC22A12SLC22A6ABCG2ALDH1A1PARP1
SCHEMBL4874193 0.72 SLC22A12 (0.39) SLC22A12SLC22A6ABCG2ALDH1A1PARP1
SCHEMBL14194771 0.72 SLC22A12 (0.39) SLC22A12SLC22A6ABCG2ALDH1A1PARP1

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-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
WO-2008004117-A1 SELECTIVE AZOLE PDE10A INHIBITOR COMPOUNDS PFIZER PRODUCTS INC. (US) 2008-01-10 WO disclosed
WO-2008004117-A1 SELECTIVE AZOLE PDE10A INHIBITOR COMPOUNDS PFIZER PRODUCTS INC. (US) 2008-01-10 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-20080090834-A1 SELECTIVE AZOLE PDE10A INHIBITOR COMPOUNDS PDE5A, PDE3B, PDE12 SLC22A12 2601/4885SLC22A6 2380/4885ABCG2 671/4885

“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.