SCHEMBL5541253

SCHEMBL5541253

COc1cccc(Cl)c1CC1CCN(C2CCc3ccccc32)C1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.39
KMT2A Q03164 3/20 0.39
DRD1 P21728 1/20 0.39
ALDH1A1 P00352 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
POLB P06746 1/20 0.39
HTR7 P34969 1/20 0.39
CMA1 P23946 1/20 0.38
MEN1 O00255 2/20 0.38
HTR2C P28335 4/20 0.37
PIN1 Q13526 2/20 0.37
HSD11B1 P28845 1/20 0.37
HTR1A P08908 3/20 0.36
DRD4 P21917 3/20 0.36
HTR2A P28223 3/20 0.36
DRD3 P35462 3/20 0.36
HTR2B P41595 3/20 0.36
HTR1D P28221 2/20 0.36
KLK7 P49862 1/20 0.36
HCRTR2 O43614 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
SCHEMBL4504607 1.00 KDM4E (0.39) KDM4EKMT2ADRD1ALDH1A1SMN1; SMN2
SCHEMBL4508542 0.90 HSD11B1 (0.42) KDM4EKMT2ADRD1ALDH1A1SMN1; SMN2
SCHEMBL4513256 0.90 HSD11B1 (0.42) KDM4EKMT2ADRD1ALDH1A1SMN1; SMN2
SCHEMBL4523992 0.90 HSD11B1 (0.42) KDM4EKMT2ADRD1ALDH1A1SMN1; SMN2
SCHEMBL4525028 0.87 DCPS (0.35) KDM4EKMT2ADRD1ALDH1A1SMN1; SMN2
SCHEMBL4519534 0.87 HTR1A (0.36) KDM4EKMT2ADRD1ALDH1A1SMN1; SMN2
SCHEMBL4525134 0.85 DRD1 (0.41) KDM4EKMT2ADRD1ALDH1A1SMN1; SMN2
SCHEMBL4511428 0.84 CYP2D6 (0.45) KDM4EKMT2AALDH1A1SMN1; SMN2POLB
SCHEMBL4513878 0.84 SIGMAR1 (0.51) DRD4
SCHEMBL4506063 0.83 TSHR (0.38) KMT2ADRD1ALDH1A1MEN1HCRTR2

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
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 KDM4E 2703/4885KMT2A 2379/4885DRD1 3030/4885

“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.