SCHEMBL14027409

SCHEMBL14027409

O=C(Cc1ncon1)Nc1ccc(F)c(Cl)c1

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.60
GAA P10253 1/20 0.60
TSHR P16473 2/20 0.56
FABP4 P15090 1/20 0.53
KDM4E B2RXH2 1/20 0.52
SMN1; SMN2 Q16637 3/20 0.49
HPGD P15428 1/20 0.48
SLC2A1 P11166 1/20 0.48
MEN1 O00255 5/20 0.47
KMT2A Q03164 5/20 0.47
MAPT P10636 2/20 0.47
LMNA P02545 1/20 0.47
HTT P42858 1/20 0.47
ALDH1A1 P00352 1/20 0.47
HSD17B10 Q99714 1/20 0.47

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
SCHEMBL20219039 0.75 TSHR (0.76) TSHRFABP4KDM4ESMN1; SMN2HPGD
SCHEMBL31023418 0.73 TSHR (0.73) TSHRFABP4KDM4ESMN1; SMN2HPGD
SCHEMBL4002460 0.73 TSHR (0.73) TSHRFABP4KDM4ESMN1; SMN2HPGD
SCHEMBL5025301 0.73 TSHR (0.53) TSHRFABP4KDM4ESMN1; SMN2HPGD
SCHEMBL27833985 0.72 TSHR (0.71) TSHRFABP4KDM4ESMN1; SMN2HPGD
SCHEMBL15302068 0.72 TSHR (1.00) L3MBTL1TSHRFABP4KDM4ESMN1; SMN2
SCHEMBL7933287 0.72 TSHR (0.71) TSHRFABP4KDM4ESMN1; SMN2HPGD
SCHEMBL10032004 0.72 TSHR (0.71) L3MBTL1TSHRFABP4KDM4EHPGD
SCHEMBL23540894 0.72 TSHR (0.66) L3MBTL1TSHRFABP4KDM4ESMN1; SMN2
SCHEMBL9775876 0.71 TSHR (0.69) TSHRFABP4KDM4ESMN1; SMN2HPGD

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7446120-B2 Peptidomimetic modulators of cell adhesion ADHEREX TECHNOLOGIES, INC. (CA) 2008-11-04 US disclosed
US-20080260829-A1 Bone morphogenic proteins (bmp); cell adhesion modulating agent; peptidomimetics of cyclic peptides comprising classical cadherin cell adhesion recognition (CAR) sequences; modulate cell adhesion and improve drug delivery NEW YORK SOCIETY FOR THE RUPTURED AND CRIPPLED MAINTAINING THE HOSPITAL FOR SPECIAL SURGERY (US) 2008-10-23 US disclosed
US-20080081831-A1 PEPTIDOMIMETIC MODULATORS OF CELL ADHESION ADHEREX TECHNOLOGIES, INC. (CA) 2008-04-03 US disclosed
US-7268115-B2 Cyclic peptides; three-dimensional structures; screening; anticancer agents; angiogenesis inhibitors; drug delivery ADHEREX TECHNOLOGIES, INC. (CA) 2007-09-11 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 (2 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-20080260829-A1 Bone morphogenic proteins (bmp); cell adhesion modulating agent; peptidomimetics of cyclic peptides comprising classical cadherin cell adhesion recognition (CAR) sequences; modulate cell adhesion and improve drug delivery BMP1, BMP2, BMP4 L3MBTL1 2651/4885GAA 3737/4885TSHR 3913/4885
US-20080081831-A1 PEPTIDOMIMETIC MODULATORS OF CELL ADHESION CDH1, EPCAM, VCAM1 L3MBTL1 1410/4885GAA 4183/4885TSHR 3900/4885

“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.