SCHEMBL4516738

SCHEMBL4516738

O=C(O)C1CCC(N2CCC(Cc3ccc(Cl)cc3Cl)C2=O)CC1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 3/20 0.50
P2RX7 Q99572 7/20 0.47
FFAR1 O14842 4/20 0.43
NOTUM Q6P988 2/20 0.43
HSD11B1 P28845 1/20 0.43
HPGD P15428 1/20 0.42
S1PR1 P21453 1/20 0.40
LTK P29376 1/20 0.40
TAOK1 Q7L7X3 1/20 0.40
S1PR5 Q9H228 1/20 0.40
PTGDR Q13258 1/20 0.39

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
SCHEMBL4517546 0.90 EPHX2 (0.51) EPHX2P2RX7FFAR1HSD11B1
SCHEMBL14365321 0.90 EPHX2 (0.51) EPHX2P2RX7FFAR1HSD11B1
SCHEMBL2995839 0.87 P2RX7 (0.44) EPHX2P2RX7FFAR1HSD11B1
SCHEMBL2996038 0.87 P2RX7 (0.44) EPHX2P2RX7FFAR1HSD11B1
SCHEMBL2990514 0.87 P2RX7 (0.44) EPHX2P2RX7FFAR1HSD11B1
SCHEMBL4523656 0.87 P2RX7 (0.46) EPHX2P2RX7
SCHEMBL2992277 0.85 P2RX7 (0.43) EPHX2P2RX7FFAR1HSD11B1
SCHEMBL2996004 0.85 P2RX7 (0.43) EPHX2P2RX7FFAR1HSD11B1
SCHEMBL3000826 0.84 HSD11B1 (0.56) EPHX2P2RX7FFAR1HSD11B1
SCHEMBL2991795 0.84 HSD11B1 (0.56) EPHX2P2RX7FFAR1HSD11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090264650-A1 Prophylactic/Therapeutic Agent for Diabetes TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-10-22 US disclosed
US-20090264650-A1 Prophylactic/Therapeutic Agent for Diabetes TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-10-22 US disclosed
US-20090264650-A1 Prophylactic/Therapeutic Agent for Diabetes TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-10-22 US disclosed
EP-1864971-A1 PROPHYLACTIC/THERAPEUTIC AGENT FOR DIABETES Takeda Pharmaceutical Company Limited (JP) 2007-12-12 EP disclosed
EP-1864971-A1 PROPHYLACTIC/THERAPEUTIC AGENT FOR DIABETES Takeda Pharmaceutical Company Limited (JP) 2007-12-12 EP 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-20090264650-A1 Prophylactic/Therapeutic Agent for Diabetes HSD11B1, HSD17B1, HSD11B2 EPHX2 670/4885P2RX7 3946/4885FFAR1 326/4885

“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.