SCHEMBL4518285

SCHEMBL4518285

COC(=O)C1CN(C2CCCCC2)C(=O)C1Cc1c(Cl)cccc1Cl

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.40
MEN1 O00255 2/20 0.40
POLB P06746 1/20 0.40
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
MAPT P10636 1/20 0.38
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
GAA P10253 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
SCHEMBL4516476 0.86 KMT2A (0.40) KMT2AMEN1POLBALDH1A1MAPT
SCHEMBL4518281 0.79 SMN1; SMN2 (0.39) KMT2AMEN1POLBALDH1A1MAPT
SCHEMBL4515989 0.79 MEN1 (0.38) KMT2AMEN1POLBALDH1A1MAPT
SCHEMBL4501069 0.78 KMT2A (0.39) KMT2AMEN1POLBALDH1A1MAPT
SCHEMBL13674436 0.78 POLB (0.40) KMT2AMEN1POLBALDH1A1MAPT
SCHEMBL13674435 0.78 KMT2A (0.45) KMT2AMEN1POLB
SCHEMBL4510432 0.77 TDP1 (0.37) KMT2AMEN1POLBKDM4EALDH1A1
Hydrochloric Acid SCHEMBL4509819 0.77 POLB (0.39) KMT2AMEN1POLBALDH1A1MAPT
SCHEMBL14365304 0.77 PARP1 (0.37) KMT2AMEN1POLBKDM4EALDH1A1
SCHEMBL4503330 0.76 LMNA (0.39) KMT2AMEN1POLBALDH1A1TDP1

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 KMT2A 2379/4885MEN1 1254/4885POLB 2628/4885

“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.