SCHEMBL5772702

SCHEMBL5772702

CCOP(=O)(Cc1ccc(NC(=O)CCc2cnoc2-c2ccc(F)c(Cl)c2)cc1)OCC

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.39
KMT2A Q03164 5/20 0.39
MAPT P10636 4/20 0.39
LMNA P02545 3/20 0.39
GLA P06280 1/20 0.39
MAPK1 P28482 1/20 0.39
TSHR P16473 1/20 0.38
BTK Q06187 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.37
LTA4H P09960 1/20 0.36
EPHX2 P34913 1/20 0.36
CNR1 P21554 1/20 0.36
CNR2 P34972 1/20 0.36
ALDH1A1 P00352 1/20 0.36
PTK2 Q05397 1/20 0.36
ENTPD1 P49961 1/20 0.35
TP53 P04637 2/20 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
SCHEMBL5773311 0.93 BTK (0.38) MEN1KMT2AMAPTLMNAGLA
SCHEMBL5773241 0.93 BTK (0.39) MEN1KMT2AMAPTLMNAGLA
SCHEMBL5774530 0.90 BTK (0.38) MEN1KMT2AMAPTLMNAGLA
SCHEMBL5777014 0.90 MEN1 (0.46) MEN1KMT2AMAPTLMNAGLA
SCHEMBL5771814 0.89 MAPT (0.40) MEN1KMT2AMAPTLMNAGLA
SCHEMBL5776568 0.89 LMNA (0.38) MEN1KMT2AMAPTLMNAGLA
SCHEMBL5771359 0.88 MEN1 (0.40) MEN1KMT2AMAPTLMNAGLA
SCHEMBL5774284 0.85 MAPT (0.37) MEN1KMT2AMAPTLMNAGLA
SCHEMBL5774650 0.85 MAPT (0.48) MEN1KMT2AMAPTLMNAMAPK1
SCHEMBL5777451 0.85 MEN1 (0.41) MEN1KMT2AMAPTLMNAGLA

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 MEN1 2811/4885KMT2A 3907/4885MAPT 4701/4885
US-20040048908-A1 Isoxazole derivatives GPR119, INSR, IRS1 MEN1 2072/4885KMT2A 2906/4885MAPT 4763/4885

“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.