SCHEMBL22386558

SCHEMBL22386558

CC(F)(F)C(=O)N(CCCCO)CCCN(CCCCN(CCCN(CCCCO)C(=O)C(F)(F)F)C(=O)C(F)(F)F)C(=O)C(F)(F)F

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CA14 Q9ULX7 1/20 0.39
MLYCD O95822 2/20 0.35
ATR Q13535 1/20 0.31
CTSK P43235 1/20 0.30

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
SCHEMBL19141766 0.91 CA14 (0.37) CA14MLYCDATR
SCHEMBL27051162 0.82 LMNA (0.46)
SCHEMBL22386559 0.81 MLYCD (0.40) CA14MLYCDCTSK
SCHEMBL19400199 0.81 MLYCD (0.38) CA14MLYCD
SCHEMBL9361432 0.75 MLYCD (0.44) MLYCD
SCHEMBL1177268 0.74 MAPT (0.35) CA14
SCHEMBL2579949 0.73 CTSK (0.44) CA14MLYCDATRCTSK
SCHEMBL8593140 0.73 CHRM2 (0.36) CA14MLYCDCTSK
SCHEMBL29411335 0.73 FAAH (0.50)
SCHEMBL10065436 0.73 MLYCD (0.41) CA14MLYCDCTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200277406-A1 BINDING AGENT ROCHE DIAGNOSTICS GMBH (DE) 2020-09-03 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-20200277406-A1 BINDING AGENT SSB, APBA1, SHBG CA14 1305/4885MLYCD 4872/4885ATR 1985/4885

“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.