SCHEMBL4520440

SCHEMBL4520440

O=C1C(Cc2c(Cl)cccc2Cl)CCN1C12CC3CC(CC(CO)(C3)C1)C2

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
IDE P14735 2/20 0.35
P2RX7 Q99572 8/20 0.34
ALDH1A1 P00352 7/20 0.34
KMT2A Q03164 1/20 0.34
LMNA P02545 2/20 0.33
EPHX2 P34913 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HSD11B1 P28845 2/20 0.32

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
SCHEMBL4507429 0.85 EPHX2 (0.37) P2RX7ALDH1A1KMT2AEPHX2SMN1; SMN2
SCHEMBL4514682 0.84 GAA (0.43) IDEP2RX7ALDH1A1KMT2AEPHX2
SCHEMBL4504367 0.83 EPHX2 (0.31) P2RX7ALDH1A1KMT2AEPHX2SMN1; SMN2
SCHEMBL4515943 0.82 P2RX7 (0.36) IDEP2RX7ALDH1A1KMT2ALMNA
SCHEMBL4501748 0.82 LMNA (0.35) P2RX7ALDH1A1KMT2ALMNAEPHX2
SCHEMBL4515995 0.81 ALDH1A1 (0.36) IDEP2RX7ALDH1A1KMT2ALMNA
SCHEMBL5543748 0.80 S1PR1 (0.34) IDEP2RX7ALDH1A1LMNAEPHX2
SCHEMBL4504312 0.79 ALDH1A1 (0.38) IDEP2RX7ALDH1A1KMT2A
SCHEMBL4501207 0.79 P2RX7 (0.34) P2RX7ALDH1A1KMT2ALMNAEPHX2
SCHEMBL4519727 0.78 HSD11B1 (0.35) P2RX7ALDH1A1KMT2ALMNAEPHX2

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 IDE 159/4885P2RX7 3946/4885ALDH1A1 51/4885

“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.