SCHEMBL25413077

SCHEMBL25413077

Cc1ccc(S(=O)(=O)N2C[C@H](Cc3ccc(C(F)(F)F)cc3)c3c(C=O)cccc32)cc1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 2/20 0.43
▸ ALDH1A1 P00352 1/20 0.41
▸ BCHE P06276 1/20 0.41
▸ ACHE P22303 1/20 0.41
▸ RORC P51449 2/20 0.38
▸ HTR6 P50406 1/20 0.38
▸ MEN1 O00255 4/20 0.37
▸ KMT2A Q03164 4/20 0.37
▸ KDM4E B2RXH2 2/20 0.37
▸ TSHR P16473 1/20 0.37
▸ MAPT P10636 4/20 0.36
▸ LMNA P02545 4/20 0.36
▸ SMN1; SMN2 Q16637 3/20 0.36
▸ UBE2N P61088 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ MCOLN3 Q8TDD5 1/20 0.35
▸ CRHBP P24387 1/20 0.34
▸ CRHR2 Q13324 1/20 0.34

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
SCHEMBL25413083 1.00 GAA (0.43) GAAALDH1A1BCHEACHERORC
SCHEMBL25413834 0.92 KDM4E (0.39) ALDH1A1ACHEHTR6KDM4ELMNA
SCHEMBL25413830 0.92 KDM4E (0.39) ALDH1A1ACHEHTR6KDM4ELMNA
SCHEMBL25412765 0.91 GAA (0.44) GAAALDH1A1RORCMEN1KMT2A
SCHEMBL25412759 0.91 GAA (0.44) GAAALDH1A1RORCMEN1KMT2A
SCHEMBL25410168 0.89 ACHE (0.38) BCHEACHEMEN1KMT2AKDM4E
SCHEMBL25410176 0.89 ACHE (0.38) BCHEACHEMEN1KMT2AKDM4E
SCHEMBL25411450 0.88 ALDH1A1 (0.40) GAAALDH1A1BCHEACHEKDM4E
SCHEMBL25411441 0.88 ALDH1A1 (0.40) GAAALDH1A1BCHEACHEKDM4E
SCHEMBL25413134 0.86 CA1 (0.42) ALDH1A1BCHEACHEHTR6MEN1

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-20230278959-A1 Synthesis of Optically Active Indoline Derivatives Via Ruthenium(II)-Catalyzed Enantioselective C-H Functionalization MISSISSIPPI STATE UNIVERSITY 2023-09-07 — — US disclosed
US-20230278959-A1 Synthesis of Optically Active Indoline Derivatives Via Ruthenium(II)-Catalyzed Enantioselective C-H Functionalization MISSISSIPPI STATE UNIVERSITY 2023-09-07 — — 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-20230278959-A1 Synthesis of Optically Active Indoline Derivatives Via Ruthenium(II)-Catalyzed Enantioselective C-H Functionalization INMT, IDO2, WEE2 GAA 4101/4885ALDH1A1 3453/4885BCHE 196/4885

“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.

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