SCHEMBL3123548

SCHEMBL3123548

CCOc1ccc(C(N)c2cncnc2)cc1OC(C)C

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
F7 P08709 12/20 0.37
ALDH1A1 P00352 2/20 0.35
F3 P13726 8/20 0.35
LMNA P02545 2/20 0.35
HTT P42858 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
SLC6A2 P23975 1/20 0.34
SLC6A4 P31645 1/20 0.34
F10 P00742 1/20 0.34
ALPL P05186 1/20 0.34

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
SCHEMBL3117907 0.90 ALDH1A1 (0.41) ALDH1A1LMNAHTTSMN1; SMN2
SCHEMBL3123596 0.86 MAPT (0.48) ALDH1A1LMNASMN1; SMN2
SCHEMBL3131098 0.85 L3MBTL1 (0.42) ALDH1A1SMN1; SMN2
SCHEMBL3117589 0.84 L3MBTL1 (0.44) ALDH1A1LMNASMN1; SMN2
SCHEMBL3129614 0.83 PDE4B (0.40) ALDH1A1LMNAHTT
SCHEMBL3129220 0.83 PDE4A (0.38)
SCHEMBL3126180 0.81 AAK1 (0.39) F7ALDH1A1F3LMNAF10
SCHEMBL3129484 0.75 F7 (0.43) F7F3SLC6A2SLC6A4F10
SCHEMBL3123524 0.73 PDE4D (0.49) ALDH1A1SLC6A2SLC6A4ALPL
SCHEMBL3123550 0.72 F2 (0.42) F7ALDH1A1LMNASMN1; SMN2F10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100029689-A1 PHOSPHODIESTERASE 4 INHIBITORS MEMORY PHARMACEUTICALS CORPORATION (US) 2010-02-04 US disclosed
WO-2010003084-A2 PHOSPHODIESTERASE 4 INHIBITORS MEMORY PHARMACEUTICALS CORPORATION (US) 2010-01-07 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-20100029689-A1 PHOSPHODIESTERASE 4 INHIBITORS PDE4A, PDE4B, PDE3B F7 3964/4885ALDH1A1 190/4885F3 1241/4885

“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.