SCHEMBL7550604

SCHEMBL7550604

CCn1ncc(C(=O)c2ccc3c(c2C)C(=O)CCS3)c1O

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.34
RAB9A P51151 2/20 0.34
LMNA P02545 2/20 0.34
ALDH1A1 P00352 2/20 0.32
GAA P10253 1/20 0.32
HTT P42858 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C19 P33261 1/20 0.32

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
SCHEMBL7544103 0.90 RAB9A (0.31) SMN1; SMN2RAB9ALMNA
SCHEMBL8123433 0.84 RAB9A (0.33) SMN1; SMN2RAB9ALMNAALDH1A1GAA
SCHEMBL8871127 0.83 POLB (0.32) SMN1; SMN2RAB9ALMNAALDH1A1GAA
SCHEMBL8871124 0.83 POLB (0.32) SMN1; SMN2RAB9ALMNAALDH1A1GAA
SCHEMBL8120118 0.82 RAB9A (0.36) SMN1; SMN2RAB9AALDH1A1HTTCYP1A2
SCHEMBL8135089 0.82 RAB9A (0.34) SMN1; SMN2RAB9ALMNAALDH1A1CYP1A2
SCHEMBL8139294 0.81 VHL (0.40) SMN1; SMN2RAB9ALMNAALDH1A1GAA
SCHEMBL7684133 0.78 SMN1; SMN2 (0.33) SMN1; SMN2RAB9ALMNAALDH1A1GAA
SCHEMBL27524777 0.74 LMNA (0.44) SMN1; SMN2RAB9ALMNAALDH1A1GAA
SCHEMBL7685463 0.74

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6465395-B2 DIHYDROBENZOTHIOPHENE-SUBSTITUTED METHYLENE; CONTROL OF A BROAD SPECTRUM OF UNDESIRABLE PLANT SPECIES. BASF AKTIENGESELLSCHAFT (DE) 2002-10-15 US disclosed
US-20020016261-A1 Substituted methylene pyrazolinones and the herbicidal use thereof BASF AKTIENGESELLSCHAFT (DE) 2002-02-07 US 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-20020016261-A1 Substituted methylene pyrazolinones and the herbicidal use thereof DDT, DHFR, TPMT SMN1; SMN2 4153/4885RAB9A 3405/4885LMNA 4370/4885

“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.