SCHEMBL4836768

SCHEMBL4836768

O=C1C2C(C(=O)N1OS(=O)(=O)C1CCCCC1)C1C(=O)N(OS(=O)(=O)C3CCCCC3)C(=O)C21

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
KMT2A Q03164 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
SCHEMBL4835917 0.88 ALDH1A1 (0.49) ALDH1A1SMN1; SMN2CYP3A4CYP2C9CYP2C19
SCHEMBL4837362 0.85
SCHEMBL1607280 0.81 PARL (0.42) SMN1; SMN2
SCHEMBL11026158 0.74 ALDH1A1 (0.50) ALDH1A1SMN1; SMN2CYP3A4CYP2C19KMT2A
SCHEMBL4835568 0.69 CA12 (0.33) ALDH1A1
SCHEMBL17130619 0.67 ALDH1A1 (0.39) ALDH1A1SMN1; SMN2CYP3A4CYP2C9KMT2A
SCHEMBL4849848 0.67 CA1 (0.39)
SCHEMBL6113279 0.67 CA1 (0.39)
SCHEMBL6113516 0.64 CA1 (0.35)
SCHEMBL30782697 0.63 CA1 (0.36) ALDH1A1

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-7374857-B2 Bismide compound, acid generator and resist composition each containing the same, and method of forming pattern from the composition WAKO PURE CHEMICAL INDUSTRIES LTD. (JP) 2008-05-20 US disclosed
US-20050038261-A1 Bismide compound, acid generator and resist composition each containing the same, and method of forming pattern from the composition WAKO PURE CHEMICAL INDUSTRIES LTD. (JP) 2005-02-17 US disclosed
EP-1449833-A1 BISIMIDE COMPOUND, ACID GENERATOR AND RESIST COMPOSITION EACH CONTAINING THE SAME, AND METHOD OF FORMING PATTERN FROM THE COMPOSITION Wako Pure Chemical Industries, Ltd. (JP) 2004-08-25 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-20050038261-A1 Bismide compound, acid generator and resist composition each containing the same, and method of forming pattern from the composition ASIC1, GAR1, RER1 ALDH1A1 633/4885SMN1; SMN2 2362/4885CYP3A4 2399/4885

“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.