SCHEMBL2494091

SCHEMBL2494091

FC(F)(F)COc1ccccc1.O=S(=O)(Cl)Cl

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.46
NPSR1 Q6W5P4 2/20 0.46
MEN1 O00255 1/20 0.46
S1PR2 O95136 1/20 0.46
S1PR4 O95977 1/20 0.46
LMNA P02545 1/20 0.46
GAA P10253 1/20 0.46
XBP1 P17861 1/20 0.46
HTT P42858 1/20 0.46
KMT2A Q03164 1/20 0.46
PAX8 Q06710 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
S1PR3 Q99500 1/20 0.46
S1PR5 Q9H228 1/20 0.46
GPR3 P46089 1/20 0.41
PIK3CD O00329 1/20 0.41
PIK3CA P42336 1/20 0.41
PIK3CB P42338 1/20 0.41
ALDH1A1 P00352 1/20 0.41
LIPE Q05469 2/20 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
SCHEMBL2494494 0.90 ALDH1A1 (0.45) MAPTNPSR1MEN1S1PR2S1PR4
SCHEMBL2280790 0.88 ALDH1A1 (0.50) MAPTNPSR1MEN1S1PR2S1PR4
Formaldehyde SCHEMBL28103446 0.86 MAPT (0.50) MAPTNPSR1MEN1S1PR2S1PR4
Water SCHEMBL27843768 0.86 LMNA (0.49) MAPTNPSR1MEN1S1PR2S1PR4
SCHEMBL28126443 0.86 LMNA (0.49) MAPTNPSR1MEN1S1PR2S1PR4
SCHEMBL2001460 0.81 WDR5 (0.44) LMNAGAAHTTKMT2ASMN1; SMN2
SCHEMBL2496247 0.80 LMNA (0.47) MAPTLMNAALDH1A1
SCHEMBL1031792 0.79 PTPRZ1 (0.45) MAPTMEN1LMNAKMT2APAX8
Acetaldehyde SCHEMBL27974244 0.79 MEN1 (0.45) MAPTNPSR1MEN1S1PR2S1PR4
Anisole SCHEMBL27928792 0.78 CA4 (0.56) MAPTNPSR1MEN1S1PR2S1PR4

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-8030499-B2 1,3-dihydro-2H-indole-2-one compound and pyrrolidine-2-one compound fused with aromatic heterocycle TAISHO PHARMACEUTICAL CO., LTD. (JP) 2011-10-04 US disclosed
US-20080318923-A1 1,3-Dihydro-2H-Indole-2-One Compound and Pyrrolidine-2-One Compound Fused With Aromatic Heterocycle TAISHO PHARMACEUTICAL CO., LTD. (JP) 2008-12-25 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-20080318923-A1 1,3-Dihydro-2H-Indole-2-One Compound and Pyrrolidine-2-One Compound Fused With Aromatic Heterocycle AVPR1B, AVPR1A, AVPR2 MAPT 672/4885NPSR1 58/4885MEN1 527/4885

“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.