SCHEMBL5207665

SCHEMBL5207665

CCC(CC)(c1ccc(NC(=O)CCc2sc(N)nc2-c2ccc(Cl)cc2)cc1)P(=O)(O)O

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.49
POLB P06746 3/20 0.42
MAPT P10636 5/20 0.41
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
FBP1 P09467 2/20 0.41
CASP3 P42574 1/20 0.39
SENP8 Q96LD8 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
SENP6 Q9GZR1 1/20 0.39
GAA P10253 3/20 0.38
ALDH1A1 P00352 2/20 0.38
PTGDR2 Q9Y5Y4 3/20 0.38
LMNA P02545 1/20 0.38
GLA P06280 1/20 0.38
MAPK1 P28482 1/20 0.38
RAB9A P51151 1/20 0.37

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
SCHEMBL5212178 0.87 MAPT (0.59) HTTPOLBMAPTMEN1KMT2A
SCHEMBL5207481 0.86 PTGDR2 (0.42) HTTPOLBMAPTMEN1KMT2A
SCHEMBL5212160 0.85 PTGDR2 (0.56) HTTPOLBMAPTMEN1KMT2A
SCHEMBL5208386 0.85 PTGDR2 (0.47) POLBMAPTMEN1KMT2ASMN1; SMN2
SCHEMBL5208947 0.85 PTGDR2 (0.41) HTTPOLBMAPTMEN1KMT2A
SCHEMBL5210751 0.85 PTGDR2 (0.47) HTTPOLBMAPTMEN1KMT2A
SCHEMBL5214020 0.85 PTGDR2 (0.41) HTTPOLBMAPTMEN1KMT2A
SCHEMBL5207663 0.84 PTGDR2 (0.46) HTTPOLBMAPTMEN1KMT2A
SCHEMBL5207911 0.83 MAPT (0.36) POLBMAPTMEN1KMT2ASMN1; SMN2
SCHEMBL5207931 0.83 MAPT (0.36) POLBMAPTMEN1KMT2ASMN1; SMN2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7183276-B2 Azole compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-02-27 US disclosed
US-20050090534-A1 Azole compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2005-04-28 US disclosed
EP-1486490-A1 AZOLE COMPOUNDS Takeda Chemical Industries, Ltd. (JP) 2004-12-15 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-20050090534-A1 Azole compounds AHR, NR0B2, NR2C2 HTT 1097/4885POLB 3507/4885MAPT 3958/4885

“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.