SCHEMBL4501748

SCHEMBL4501748

COC(=O)C12CC3CC(C1)CC(N1CCC(Cc4c(Cl)cccc4Cl)C1=O)(C3)C2

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.35
MAPT P10636 1/20 0.35
HTT P42858 3/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
NPSR1 Q6W5P4 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
ALDH1A1 P00352 6/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
P2RX7 Q99572 4/20 0.34
EPHX2 P34913 1/20 0.34
DRD2 P14416 1/20 0.34
DRD3 P35462 1/20 0.34
HSD11B1 P28845 1/20 0.34

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
SCHEMBL4514682 0.89 GAA (0.43) MAPTSMN1; SMN2KMT2AALDH1A1P2RX7
SCHEMBL4507429 0.82 EPHX2 (0.37) MAPTSMN1; SMN2NPSR1MEN1KMT2A
SCHEMBL4520440 0.82 IDE (0.35) LMNASMN1; SMN2KMT2AALDH1A1P2RX7
SCHEMBL4504367 0.82 EPHX2 (0.31) SMN1; SMN2MEN1KMT2AALDH1A1P2RX7
SCHEMBL4501207 0.76 P2RX7 (0.34) LMNAMAPTHTTSMN1; SMN2NPSR1
SCHEMBL4519727 0.75 HSD11B1 (0.35) LMNAMAPTHTTSMN1; SMN2NPSR1
SCHEMBL14365292 0.75 HSD11B1 (0.36) EPHX2HSD11B1
SCHEMBL4501285 0.69 ALDH1A1 (0.38) LMNAMAPTHTTSMN1; SMN2NPSR1
SCHEMBL14365303 0.69 P2RX7 (0.37) LMNASMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL5127854 0.67 P2RX7 (0.38) LMNAHTTSMN1; SMN2NPSR1ALDH1A1

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 LMNA 2846/4885MAPT 4692/4885HTT 3659/4885

“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.