SCHEMBL4036300

SCHEMBL4036300

O=C(NCCc1ccccc1F)[C@@H]1Cc2ccccc2N1S(=O)(=O)c1ccc(I)cc1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.50
HPGD P15428 1/20 0.50
ATM Q13315 1/20 0.43
POLB P06746 2/20 0.42
TP53 P04637 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
MAPT P10636 2/20 0.42
PTGER3 P43115 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
PKM P14618 1/20 0.39
ALDH1A1 P00352 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
KDM4E B2RXH2 1/20 0.38
HSD17B10 Q99714 1/20 0.38
CFD P00746 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
SCHEMBL926180 0.88 LMNA (0.48) LMNAHPGDATMPOLBTP53
SCHEMBL4030921 0.87 TRPA1 (0.49) LMNAHPGDATMPOLBTP53
SCHEMBL4033863 0.84 LMNA (0.45) LMNAHPGDATMPOLBTP53
SCHEMBL4032575 0.83 TRPA1 (0.46) LMNAHPGDTP53L3MBTL1PTGER3
SCHEMBL926737 0.78 LMNA (0.46) LMNAPOLBMAPTPTGER3PKM
SCHEMBL4030551 0.78 LMNA (0.40) LMNAATMPOLBTP53L3MBTL1
SCHEMBL926215 0.77 PSEN1 (0.51) ALDH1A1NPSR1
SCHEMBL926976 0.77 HSD11B1 (0.46) LMNAL3MBTL1MAPTPTGER3PKM
SCHEMBL926719 0.77 MMP8 (0.51) POLBALDH1A1NPSR1
SCHEMBL4844597 0.77 MMP8 (0.44) POLBMAPTPTGER3ALDH1A1NPSR1

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
EP-1885695-B1 INDOLINE COMPOUNDS FOURNIER LAB SA (FR) 2009-02-25 EP disclosed
US-7465811-B2 Indoline compounds LABORATOIRES FOURNIER S.A. (FR) 2008-12-16 US disclosed
US-20080119465-A1 Novel Indoline Compounds LABORATORIES FOURNIER S.A. (FR) 2008-05-22 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-20080119465-A1 Novel Indoline Compounds GPR119, INSR, IRS1 LMNA 1943/4885HPGD 3316/4885ATM 1808/4885

“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.