SCHEMBL5770174

SCHEMBL5770174

Cc1nccn1-c1ccc(NC(=O)CCc2cnoc2-c2ccc(Cl)cc2)cn1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.41
MAPT P10636 3/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
GLA P06280 1/20 0.41
MAPK1 P28482 1/20 0.41
CYP3A4 P08684 2/20 0.41
CYP2D6 P10635 2/20 0.41
KCNH2 Q12809 1/20 0.41
GPR142 Q7Z601 1/20 0.41
POLB P06746 1/20 0.40
PORCN Q9H237 1/20 0.37
CNR2 P34972 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
TP53 P04637 1/20 0.35
ALDH1A1 P00352 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
HSD17B10 Q99714 1/20 0.35

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
SCHEMBL5774865 0.76 LMNA (0.61) LMNAMAPTMEN1KMT2AMAPK1
SCHEMBL5776159 0.73 MAPT (0.52) LMNAMAPTMEN1KMT2AGLA
SCHEMBL7955846 0.73 POLB (0.41) LMNAMAPTMEN1KMT2AGLA
SCHEMBL5773534 0.72 MAPT (0.42) LMNAMAPTMEN1KMT2AGLA
SCHEMBL5775544 0.71 LTA4H (0.48) LMNAMAPTMEN1KMT2AGLA
SCHEMBL5777470 0.71 DGAT1 (0.51) LMNAMAPTSMN1; SMN2
SCHEMBL5773537 0.71 MAPT (0.43) LMNAMAPTMEN1KMT2AGLA
SCHEMBL5777020 0.70 MAPT (0.42) LMNAMAPTMEN1KMT2AGLA
SCHEMBL5777014 0.70 MEN1 (0.46) LMNAMAPTMEN1KMT2AGLA
SCHEMBL5800098 0.70 MCHR1 (0.43) LMNAMAPTMEN1KMT2AGLA

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-20060084690-A1 Isoxazole derivatives MOMOSE YU 2006-04-20 US disclosed
US-7022725-B2 Isoxazole derivatives TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-04-04 US disclosed
US-20040048908-A1 Isoxazole derivatives TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-03-11 US disclosed
EP-1340749-A1 ISOXAZOLE DERIVATIVES Takeda Chemical Industries, Ltd. (JP) 2003-09-03 EP 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-20060084690-A1 Isoxazole derivatives INSR, GPR119, INSRR LMNA 2770/4885MAPT 4701/4885MEN1 2811/4885
US-20040048908-A1 Isoxazole derivatives GPR119, INSR, IRS1 LMNA 2605/4885MAPT 4763/4885MEN1 2072/4885

“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.