SCHEMBL7075428

SCHEMBL7075428

CCOC(=O)CC1Cc2cc(OCCCN)ccc2NC1=O

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.42
PDE3B Q13370 8/20 0.41
PDE3A Q14432 8/20 0.41
TSHR P16473 1/20 0.41
HSD17B10 Q99714 1/20 0.41
FFAR1 O14842 1/20 0.40
PPARD Q03181 1/20 0.39
PDE4A P27815 1/20 0.38
PDE4B Q07343 1/20 0.38
PDE4C Q08493 1/20 0.38
PDE4D Q08499 1/20 0.38
ITGB3 P05106 1/20 0.38
ITGA2B P08514 1/20 0.38
THRA P10827 1/20 0.36
THRB P10828 1/20 0.36
OPRM1 P35372 1/20 0.36
P2RY12 Q9H244 1/20 0.36

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
SCHEMBL7076613 0.86 PDE3B (0.38) BRD4PDE3BPDE3ATSHRHSD17B10
SCHEMBL7072126 0.83 CA12 (0.46) BRD4PDE3BPDE3A
SCHEMBL1018625 0.82 TSHR (0.43) TSHRHSD17B10OPRM1
SCHEMBL7073283 0.81 HSD17B1 (0.47) TSHRHSD17B10OPRM1
SCHEMBL19055480 0.80 CYP1A2 (0.43) BRD4TSHRHSD17B10
SCHEMBL12798841 0.78 PPARD (0.64) PPARD
SCHEMBL8304087 0.77 HSD17B10 (0.55) BRD4TSHRHSD17B10
SCHEMBL7073100 0.77 ITGB3 (0.43) PPARDITGB3ITGA2B
SCHEMBL1016536 0.77 MAPT (0.43) TSHRHSD17B10
SCHEMBL7078710 0.76 PDE3B (0.42) BRD4PDE3BPDE3ATSHROPRM1

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-20030109523-A1 Bicyclic antagonists selective for the alphavbeta3 integrin WYETH (US) 2003-06-12 US disclosed
US-6429214-B1 INHIBITORS OF BONE RESORPTION WYETH 2002-08-06 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-20030109523-A1 Bicyclic antagonists selective for the alphavbeta3 integrin ITGAV, ITGB2, ITGB3 BRD4 683/4885PDE3B 518/4885PDE3A 700/4885

“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.