SCHEMBL29317879

SCHEMBL29317879

COC(=O)c1cc(OC)cc(Oc2ncnc3ccsc23)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.44
POLB P06746 1/20 0.44
HPGD P15428 1/20 0.44
MET P08581 3/20 0.42
KDR P35968 7/20 0.41
PDGFRA P16234 1/20 0.41
PDGFRB P09619 1/20 0.39
FLT4 P35916 1/20 0.39
RAF1 P04049 1/20 0.39
BRAF P15056 1/20 0.39
RAB9A P51151 2/20 0.39
LMNA P02545 1/20 0.39
MEN1 O00255 1/20 0.39
ALDH1A1 P00352 1/20 0.39
KMT2A Q03164 1/20 0.39
AURKA O14965 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
GAA P10253 1/20 0.39
CYP2C9 P11712 1/20 0.39

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
SCHEMBL29317891 0.94 MET (0.44) SMN1; SMN2METKDRPDGFRAPDGFRB
SCHEMBL29317895 0.81 RAB9A (0.63) SMN1; SMN2POLBHPGDKDRPDGFRB
SCHEMBL30050319 0.79 KDR (0.61) METKDRPDGFRAPDGFRBFLT4
SCHEMBL29317869 0.79 KDR (0.61) METKDRPDGFRAPDGFRBFLT4
SCHEMBL30051499 0.77 KDR (0.41) METKDRPDGFRAPDGFRBFLT4
SCHEMBL29318810 0.77 KDR (0.41) METKDRPDGFRAPDGFRBFLT4
SCHEMBL30049965 0.74 RAB9A (0.41) SMN1; SMN2METKDRRAF1BRAF
SCHEMBL29317884 0.74 RAB9A (0.41) SMN1; SMN2METKDRRAF1BRAF
SCHEMBL7227815 0.72 AXL (0.53) RAB9ALMNAMEN1ALDH1A1KMT2A
SCHEMBL14074693 0.71 ADORA2A (0.56) SMN1; SMN2KDRBRAFRAB9AMEN1

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-20240239806-A1 COMPOUNDS, COMPOSITIONS AND METHODS OF TREATING DISORDERS CHENGDU ANTICANCER BIOSCIENCE LTD (CN) 2024-07-18 US disclosed
US-20240239806-A1 COMPOUNDS, COMPOSITIONS AND METHODS OF TREATING DISORDERS CHENGDU ANTICANCER BIOSCIENCE LTD (CN) 2024-07-18 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-20240239806-A1 COMPOUNDS, COMPOSITIONS AND METHODS OF TREATING DISORDERS CYP27A1, CPT1A, OAT SMN1; SMN2 672/4885POLB 1619/4885HPGD 274/4885

“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.