SCHEMBL8226010

SCHEMBL8226010

N=C1OCCN1c1ccc(N2Cc3c(NC(=O)c4ccc(Cl)s4)cccc3C2=O)cc1

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
F10 P00742 16/20 0.46
GRM1 Q13255 2/20 0.40
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ABCB11 O95342 1/20 0.39
F2 P00734 1/20 0.39
ST14 Q9Y5Y6 1/20 0.39
STK33 Q9BYT3 1/20 0.38

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
SCHEMBL3614130 0.96 F10 (0.43) F10GRM1ALDH1A1HPGDSMN1; SMN2
SCHEMBL13070056 0.90 F10 (0.39) F10GRM1ABCB11F2ST14
SCHEMBL3981509 0.86 F10 (0.61) F10ABCB11F2ST14
SCHEMBL13550371 0.85 F10 (0.45) F10GRM1ALDH1A1HPGDSMN1; SMN2
SCHEMBL8234151 0.85 F10 (0.44) F10ALDH1A1HPGDSMN1; SMN2ABCB11
SCHEMBL8225992 0.84 F10 (0.61) F10ALDH1A1HPGDSMN1; SMN2STK33
SCHEMBL3617551 0.82 F10 (0.42) F10GRM1ALDH1A1HPGDSMN1; SMN2
SCHEMBL3613837 0.81 F10 (0.58) F10ALDH1A1HPGDSMN1; SMN2
SCHEMBL3606113 0.81 AHR (0.42) F10GRM1ALDH1A1HPGDSMN1; SMN2
SCHEMBL3380064 0.80 F10 (0.38) F10GRM1ALDH1A1ABCB11F2

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-20100010060-A1 Isoindolin-1-One-, Isoindolin-3-One- and Isoindolin-1,3-Dione-Derivatives and Use Thereof BAYER HEALTHCARE AG (DE) 2010-01-14 US disclosed
US-20100010060-A1 Isoindolin-1-One-, Isoindolin-3-One- and Isoindolin-1,3-Dione-Derivatives and Use Thereof BAYER HEALTHCARE AG (DE) 2010-01-14 US disclosed
WO-2007137800-A1 ISOINDOLIN-1-ONE-, ISOINDOLIN-3-ONE- AND ISOINDOLIN-1,3-DIONE-DERIVATIVES AND USE THEREOF BAYER HEALTHCARE AG (DE) 2007-12-06 WO 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-20100010060-A1 Isoindolin-1-One-, Isoindolin-3-One- and Isoindolin-1,3-Dione-Derivatives and Use Thereof ICAM1, SERPINC1, TFPI2 F10 264/4885GRM1 3235/4885ALDH1A1 229/4885

“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.