SCHEMBL4878495

SCHEMBL4878495

Cc1ccc(-n2cc(-c3ccccn3)nc2-c2ccc(-n3ccc4nccnc43)cc2)cn1

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 2/20 0.36
PTGS2 P35354 5/20 0.35
PDE10A Q9Y233 4/20 0.35
PDE4B Q07343 1/20 0.34
MAPT P10636 2/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
PPP1CA P62136 1/20 0.34
KMT2A Q03164 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
FLT3 P36888 1/20 0.33
ALOX5AP P20292 1/20 0.33
IRAK4 Q9NWZ3 1/20 0.33
TGFBR1 P36897 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
SCHEMBL4808476 0.89 PTGS1 (0.38) PTGS1PTGS2PDE10APDE4BMAPT
SCHEMBL4807541 0.88 MAPT (0.43) PTGS1PTGS2MAPTCYP1A2CYP2C9
SCHEMBL4806864 0.88 PDE10A (0.43) PTGS1PTGS2PDE10APDE4BMAPT
SCHEMBL4878202 0.84 MKNK2 (0.42) PTGS1PTGS2MAPTFLT3
SCHEMBL4876566 0.84 DGAT1 (0.36) PTGS1PTGS2PDE10AMAPTCYP1A2
SCHEMBL4874597 0.83 PTGS1 (0.39) PTGS1PTGS2PDE10APDE4BMAPT
SCHEMBL4869273 0.82 PDE10A (0.47) PDE10APDE4BMAPTKMT2A
SCHEMBL4806996 0.82 PTGS2 (0.39) PTGS1PTGS2PDE10AMAPTFLT3
SCHEMBL4809173 0.82 DGAT1 (0.35) PTGS1PTGS2PDE10AMAPTFLT3
SCHEMBL4808161 0.81 PTGS1 (0.39) PTGS1PTGS2PDE10AMAPTCYP1A2

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 4 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 claimed
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 854/4885PDE10A 8/4885

“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.