SCHEMBL4040204

SCHEMBL4040204

O=C(NCCc1ccccc1F)[C@@H]1Cc2ccccc2N1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.49
GAA P10253 1/20 0.49
KDM4E B2RXH2 3/20 0.43
HSD17B10 Q99714 1/20 0.43
NAMPT P43490 1/20 0.43
CNR1 P21554 1/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
TAAR1 Q96RJ0 1/20 0.42
NPC1 O15118 2/20 0.41
PAX8 Q06710 1/20 0.41
KLF5 Q13887 1/20 0.41
TRPV1 Q8NER1 1/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
HPGD P15428 1/20 0.41
HTR1A P08908 2/20 0.40
HTR2A P28223 2/20 0.40
DRD3 P35462 2/20 0.40
TDP1 Q9NUW8 1/20 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
SCHEMBL928059 0.82 MEN1 (0.60) MAPTGAAKDM4EMEN1KMT2A
SCHEMBL7044730 0.79 GAA (0.56) MAPTGAAMEN1KMT2AHPGD
SCHEMBL14294241 0.79 GAA (0.56) MAPTGAAMEN1KMT2AHPGD
SCHEMBL14607110 0.78 GAA (0.59) MAPTGAAMEN1KMT2AHTR1A
SCHEMBL7044762 0.77 MAPT (0.54) MAPTGAAKDM4EHSD17B10MEN1
SCHEMBL7045251 0.76 GAA (0.59) MAPTGAAMEN1KMT2AHTR1A
SCHEMBL23772879 0.76 GAA (0.52) MAPTGAANAMPTMEN1KMT2A
SCHEMBL31210254 0.75 GAA (0.46) MAPTGAAMEN1KMT2AHTR1A
SCHEMBL17032932 0.75 P2RX7 (0.49) MAPTGAA
SCHEMBL3535333 0.75 GAA (0.62) MAPTGAAMEN1KMT2AHTR1A

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 MAPT 763/4885GAA 1612/4885KDM4E 1574/4885

“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.