SCHEMBL4874798

SCHEMBL4874798

CN(Cc1ccc(-n2cc(-c3nccs3)nc2-c2ccc(-n3ccc4cccnc43)cc2)cc1)C(=O)OC(C)(C)C

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 1/20 0.34
GBA1 P04062 1/20 0.33
HTR2C P28335 1/20 0.32
SLC6A4 P31645 1/20 0.32
PAX8 Q06710 1/20 0.31
METAP1 P53582 1/20 0.31
PTGS1 P23219 1/20 0.31
NR1H2 P55055 1/20 0.30
PDE11A Q9HCR9 1/20 0.30

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
SCHEMBL4875378 0.93 GBA1 (0.35) GPR119GBA1PAX8METAP1NR1H2
SCHEMBL4875766 0.90 PDE11A (0.34) PTGS1PDE11A
SCHEMBL4874188 0.85 PDE11A (0.33) PTGS1PDE11A
SCHEMBL4874807 0.84 AKT1 (0.42) GPR119METAP1NR1H2
SCHEMBL4875387 0.83 AKT1 (0.38) METAP1NR1H2
SCHEMBL4869383 0.79 ADRB2 (0.48) PTGS1
SCHEMBL4875774 0.79 SMN1; SMN2 (0.35) PTGS1
Hydrochloric Acid SCHEMBL4874628 0.78 ADRB2 (0.47) PTGS1
SCHEMBL4861340 0.78 CRHR1 (0.39) PTGS1
SCHEMBL4855850 0.78 ADRB2 (0.37) PTGS1

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 GPR119 351/4885GBA1 1296/4885HTR2C 2358/4885

“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.