SCHEMBL6499705

SCHEMBL6499705

CCOC(=O)CCCOc1cc(C)c2nc(C)n(Cc3ccc(OCC)cc3C(F)(F)F)c2c1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 2/20 0.40
PDE3B Q13370 2/20 0.40
PDE3A Q14432 2/20 0.40
P2RY12 Q9H244 1/20 0.40
PLA2G2A P14555 3/20 0.40
BRD4 O60885 1/20 0.39
CYSLTR2 Q9NS75 3/20 0.38
CYSLTR1 Q9Y271 3/20 0.38
MCL1 Q07820 2/20 0.38
AR P10275 1/20 0.35
FAAH O00519 1/20 0.35
PIK3CD O00329 1/20 0.35
PIK3C2B O00750 1/20 0.35
PIK3R1 P27986 1/20 0.35
PIK3CB P42338 1/20 0.35

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
SCHEMBL6488835 0.92 MCL1 (0.42) PDE3BPDE3AP2RY12PLA2G2AMCL1
SCHEMBL6496755 0.90 PDE3B (0.44) PDK2PDE3BPDE3AP2RY12PLA2G2A
SCHEMBL6489517 0.89 PDE3B (0.43) PDK2PDE3BPDE3AP2RY12PLA2G2A
SCHEMBL6487030 0.87 PDE3B (0.42) PDK2PDE3BPDE3AP2RY12PLA2G2A
SCHEMBL6488241 0.87 MCL1 (0.43) PDK2PDE3BPDE3AP2RY12PLA2G2A
SCHEMBL6496808 0.85 PPARG (0.38) PDK2PDE3BPDE3AP2RY12PLA2G2A
SCHEMBL6487271 0.85 PDE3B (0.42) PDK2PDE3BPDE3AP2RY12PLA2G2A
SCHEMBL6487942 0.82 MCL1 (0.42) PDE3BPDE3AP2RY12PLA2G2ABRD4
SCHEMBL6488122 0.82 MCL1 (0.46) PDE3BPDE3AP2RY12PLA2G2AMCL1
SCHEMBL6491512 0.81 MCL1 (0.41) PDE3BPDE3AP2RY12PLA2G2ABRD4

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-20050014812-A1 Benzimidazole compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2005-01-20 US disclosed
WO-2004108686-A2 BENZIMIDAZOLE COMPOUNDS HAVING HYPOGLYCEMIC ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-12-16 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-20050014812-A1 Benzimidazole compounds SLC5A1, SLC5A2, G6PD PDK2 128/4885PDE3B 411/4885PDE3A 733/4885

“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.