SCHEMBL6487271

SCHEMBL6487271

C=Cc1cc(OCC)ccc1Cn1c(C)nc2c(C)cc(OCCCC(=O)OCC)cc21

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 2/20 0.42
PDE3A Q14432 2/20 0.42
P2RY12 Q9H244 1/20 0.42
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
PTPN1 P18031 2/20 0.36
AR P10275 1/20 0.35
FAAH O00519 2/20 0.35
MAPK1 P28482 1/20 0.35
PDK2 Q15119 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
SCHEMBL6496755 0.90 PDE3B (0.44) PDE3BPDE3AP2RY12PLA2G2ABRD4
SCHEMBL6489517 0.89 PDE3B (0.43) PDE3BPDE3AP2RY12PLA2G2ABRD4
SCHEMBL6487030 0.87 PDE3B (0.42) PDE3BPDE3AP2RY12PLA2G2ABRD4
SCHEMBL6488241 0.87 MCL1 (0.43) PDE3BPDE3AP2RY12PLA2G2ABRD4
SCHEMBL6499705 0.85 PDK2 (0.40) PDE3BPDE3AP2RY12PLA2G2ABRD4
SCHEMBL6487942 0.82 MCL1 (0.42) PDE3BPDE3AP2RY12PLA2G2ABRD4
SCHEMBL6488122 0.82 MCL1 (0.46) PDE3BPDE3AP2RY12PLA2G2AMCL1
SCHEMBL6491512 0.81 MCL1 (0.41) PDE3BPDE3AP2RY12PLA2G2ABRD4
SCHEMBL6497299 0.81 PDE3B (0.40) PDE3BPDE3AP2RY12PLA2G2AMCL1
SCHEMBL6502915 0.81 SMN1; SMN2 (0.44) 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 1 patent. 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

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 PDE3B 411/4885PDE3A 733/4885P2RY12 2028/4885

“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.