SCHEMBL4508795

SCHEMBL4508795

O=C1CCC(N2CCC(Cc3ccc(NC(=O)C4(O)CC4)cc3Cl)C2=O)CC1

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPY2R P49146 1/20 0.35
HSD11B1 P28845 1/20 0.34
P2RX7 Q99572 4/20 0.34
KDM4E B2RXH2 1/20 0.33
RECQL P46063 1/20 0.33
CYP2D6 P10635 2/20 0.33
CYP2C19 P33261 2/20 0.33
AADAT Q8N5Z0 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
THRB P10828 1/20 0.32
HPGD P15428 1/20 0.32
GSPT1 P15170 2/20 0.32
CRBN Q96SW2 2/20 0.32
MCHR1 Q99705 1/20 0.32
ALDH1A1 P00352 1/20 0.32
DDB1 Q16531 1/20 0.32
MAPT P10636 1/20 0.32
CYP3A4 P08684 1/20 0.31

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
SCHEMBL4505621 0.90 NPY2R (0.36) NPY2RHSD11B1P2RX7KDM4ERECQL
SCHEMBL4502644 0.85 EPHX2 (0.42) NPY2RHSD11B1P2RX7HPGD
SCHEMBL5548898 0.80 RORC (0.39) HSD11B1P2RX7KDM4ECYP2D6CYP2C19
SCHEMBL4514917 0.79 KMT2A (0.42) MEN1KMT2AHPGDALDH1A1MAPT
SCHEMBL4509871 0.79 GAA (0.41) HSD11B1HPGD
SCHEMBL4513997 0.78 HSD11B1 (0.41) HSD11B1P2RX7
SCHEMBL2208659 0.78 HSD11B1 (0.43) HSD11B1P2RX7
SCHEMBL4505657 0.78 EPHX2 (0.41) NPY2RHSD11B1P2RX7MCHR1
SCHEMBL13675514 0.77 RORC (0.38) HSD11B1KDM4EHPGDCRBNMCHR1
SCHEMBL2206955 0.77 P2RX7 (0.43) HSD11B1P2RX7KDM4ECYP2D6CYP2C19

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 4 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

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 NPY2R 3347/4885HSD11B1 1/4885P2RX7 3946/4885

“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.