SCHEMBL4516723

SCHEMBL4516723

O=C(CCc1ccc(CC2CCN(C3CCCCC3)C2=O)c(Cl)c1)Nc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.51
POLB P06746 2/20 0.43
MAPT P10636 4/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
NPC1 O15118 1/20 0.41
ACKR3 P25106 1/20 0.40
HTT P42858 2/20 0.40
ALDH1A1 P00352 3/20 0.39
GAA P10253 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
MCHR1 Q99705 2/20 0.39
CHRM1 P11229 1/20 0.39
HTR2A P28223 1/20 0.39
GSPT1 P15170 1/20 0.39
CRBN Q96SW2 1/20 0.39
LMNA P02545 1/20 0.38

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
SCHEMBL4519281 0.87 HSD11B1 (0.53) HSD11B1GAALMNA
SCHEMBL4522654 0.84 HSD11B1 (0.49) HSD11B1SMN1; SMN2ALDH1A1KMT2ALMNA
SCHEMBL4510127 0.83 HSD11B1 (0.47) HSD11B1POLBSMN1; SMN2ALDH1A1MEN1
SCHEMBL4510247 0.82 HSD11B1 (0.47) HSD11B1NPC1ALDH1A1MEN1KMT2A
SCHEMBL13675464 0.81 PTGDR2 (0.44) HSD11B1MAPTSMN1; SMN2NPC1ALDH1A1
SCHEMBL2995925 0.81 HSD11B1 (0.65) HSD11B1SMN1; SMN2ALDH1A1GAALMNA
SCHEMBL4514751 0.80 PTGDR2 (0.44) HSD11B1MAPTSMN1; SMN2NPC1ALDH1A1
SCHEMBL4513595 0.80 HSD11B1 (0.46) HSD11B1POLBSMN1; SMN2ALDH1A1MCHR1
SCHEMBL4515140 0.80 HSD11B1 (0.45) HSD11B1POLBSMN1; SMN2ALDH1A1
SCHEMBL13674559 0.80 HSD11B1 (0.43) HSD11B1POLBSMN1; SMN2ALDH1A1MCHR1

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 HSD11B1 1/4885POLB 2628/4885MAPT 4692/4885

“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.