SCHEMBL10064334

SCHEMBL10064334

CCOc1nn(C(C)C)c(C)c1Cc1ccc(C)c(F)c1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDE1A P54750 12/20 0.38
PDE1B Q01064 12/20 0.38
PDE1C Q14123 12/20 0.38
SLC5A1 P13866 2/20 0.37
SLC5A2 P31639 2/20 0.37
MPO P05164 1/20 0.33
DAO P14920 1/20 0.33
P2RX7 Q99572 1/20 0.32
P2RX3 P56373 1/20 0.32
KDM4E B2RXH2 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
DHODH Q02127 1/20 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
SCHEMBL10064335 0.87 CHRM4 (0.38) SLC5A1SLC5A2P2RX7KDM4ENPC1
SCHEMBL10031316 0.85 SLC5A1 (0.37) SLC5A1SLC5A2DAOP2RX7P2RX3
SCHEMBL14285953 0.82 SLC5A2 (0.41) SLC5A1SLC5A2P2RX7P2RX3DHODH
SCHEMBL10064922 0.78 SLC5A1 (0.57) PDE1APDE1BPDE1CSLC5A1SLC5A2
SCHEMBL14285952 0.76 SLC5A1 (0.43) SLC5A1SLC5A2P2RX3DHODH
SCHEMBL14626488 0.75 SLC5A1 (0.45) SLC5A1SLC5A2P2RX7KDM4EDHODH
SCHEMBL2047708 0.74 SLC5A2 (0.72) SLC5A1SLC5A2
SCHEMBL3772111 0.74 SLC5A2 (0.72) SLC5A1SLC5A2
SCHEMBL14143695 0.73 SLC5A2 (0.75) SLC5A1SLC5A2
SCHEMBL3772848 0.73 SLC5A2 (0.75) SLC5A1SLC5A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120053330-A1 Chemical Process GLAXOSMITHKLINE LLC 2012-03-01 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-20120053330-A1 Chemical Process SLC5A2, SLC5A1, UGGT1 PDE1A 4599/4885PDE1B 4434/4885PDE1C 4662/4885

“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.