SCHEMBL569649

SCHEMBL569649

CC(C)(C)OC(=O)N1CC(F)(c2ccc(/C=N\O)cc2)C1

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RORC P51449 12/20 0.37
HDAC1 Q13547 1/20 0.37
MIF P14174 1/20 0.36
NPC1 O15118 1/20 0.35
RECQL P46063 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
CTSD P07339 1/20 0.35
CTSE P14091 1/20 0.35
BACE1 P56817 1/20 0.35
KMT2A Q03164 1/20 0.35
MAPT P10636 1/20 0.34
TACR1 P25103 1/20 0.34
NR1H2 P55055 1/20 0.34

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
SCHEMBL569650 1.00 RORC (0.37) RORCHDAC1MIFNPC1RECQL
SCHEMBL10255921 1.00 RORC (0.37) RORCHDAC1MIFNPC1RECQL
SCHEMBL569912 0.86 RORC (0.38) RORCHDAC1MIFNPC1RECQL
SCHEMBL569914 0.86 RORC (0.38) RORCHDAC1MIFNPC1RECQL
SCHEMBL569913 0.86 RORC (0.38) RORCHDAC1MIFNPC1RECQL
SCHEMBL569495 0.86 RORC (0.39) RORCHDAC1CTSDCTSEBACE1
SCHEMBL18587858 0.80 RORC (0.40) RORCSMN1; SMN2CTSDCTSEBACE1
SCHEMBL569652 0.80 RORC (0.54) RORCCTSDCTSEBACE1
SCHEMBL15223009 0.80 RORC (0.50) RORCTACR1
SCHEMBL15155806 0.79 GPR119 (0.50) RORCNPC1CTSDCTSEBACE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2601190-B1 ISOXAZOLINE DERIVATIVES AS ANTIPARASITIC AGENTS ZOETIS SERVICES LLC (US) 2018-07-04 EP disclosed
EP-2601190-A1 ISOXAZOLINE DERIVATIVES AS ANTIPARASITIC AGENTS AH USA 42 LLC (US) 2013-06-12 EP disclosed
US-8415310-B2 Isoxazoline derivatives as antiparasitic agents AH USA 42 LLC (US) 2013-04-09 US disclosed
US-20120035122-A1 ISOXAZOLINE DERIVATIVES AS ANTIPARASITIC AGENTS ZOETIS SERVICES LLC 2012-02-09 US disclosed
WO-2012017359-A1 ISOXAZOLINE DERIVATIVES AS ANTIPARASITIC AGENTS PFIZER INC. (US) 2012-02-09 WO 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-20120035122-A1 ISOXAZOLINE DERIVATIVES AS ANTIPARASITIC AGENTS ADORA1, CYP3A7, RDX RORC 519/4885HDAC1 1574/4885MIF 3348/4885

“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.