SCHEMBL4933920

SCHEMBL4933920

COCOc1ccc(-n2c(SCc3cccnc3)nc3ccc(Cl)cc32)cc1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDE7A Q13946 1/20 0.45
ALDH1A1 P00352 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
USP2 O75604 2/20 0.43
RAB9A P51151 1/20 0.43
KDM4E B2RXH2 1/20 0.42
AOC2 O75106 1/20 0.42
TSHR P16473 1/20 0.41
TP53 P04637 1/20 0.40
POLB P06746 1/20 0.40

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
SCHEMBL4925854 0.89 PDE7A (0.41) PDE7ASMN1; SMN2
SCHEMBL304446 0.88 HTT (0.46)
SCHEMBL29434809 0.88 HTT (0.46)
SCHEMBL4930349 0.84 HTT (0.41)
SCHEMBL4925638 0.83 PDE7A (0.45) PDE7AALDH1A1SMN1; SMN2RAB9A
SCHEMBL4925147 0.83 MEN1 (0.42) ALDH1A1SMN1; SMN2RAB9A
SCHEMBL4931954 0.80 KMT2A (0.52) SMN1; SMN2
SCHEMBL2520513 0.79 HTT (0.45)
SCHEMBL4928736 0.79 HTT (0.46) ALDH1A1SMN1; SMN2
SCHEMBL4930107 0.79 TP53 (0.50) TP53POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080021069-A1 Receptor Function Regulating Agent TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-01-24 US disclosed
US-20080021069-A1 Receptor Function Regulating Agent TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-01-24 US disclosed
US-20080021069-A1 Receptor Function Regulating Agent TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-01-24 US disclosed
EP-1810677-A1 RECEPTOR FUNCTION REGULATING AGENT Takeda Pharmaceutical Company Limited (JP) 2007-07-25 EP disclosed
EP-1810677-A1 RECEPTOR FUNCTION REGULATING AGENT Takeda Pharmaceutical Company Limited (JP) 2007-07-25 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-20080021069-A1 Receptor Function Regulating Agent GPR119, INSR, GPR65 PDE7A 1138/4885ALDH1A1 1870/4885SMN1; SMN2 4521/4885

“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.