SCHEMBL4336057

SCHEMBL4336057

OCCNCc1cc(F)c(F)c(F)c1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GSR P00390 2/20 0.49
SMN1; SMN2 Q16637 3/20 0.41
CD274 Q9NZQ7 2/20 0.39
PDCD1 Q15116 1/20 0.39
ALDH1A1 P00352 1/20 0.37
TSHR P16473 1/20 0.37
USP28 Q96RU2 2/20 0.36
PDCD1LG2 Q9BQ51 1/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
VSIR Q9H7M9 2/20 0.34
CHRM2 P08172 1/20 0.34
KDM4E B2RXH2 1/20 0.34
POLB P06746 1/20 0.34
USP25 Q9UHP3 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
SCHEMBL28300111 0.81 GSR (0.50) GSRSMN1; SMN2CD274PDCD1ALDH1A1
SCHEMBL2854317 0.80 SMN1; SMN2 (0.46) GSRSMN1; SMN2CD274PDCD1ALDH1A1
SCHEMBL22395226 0.76 CYP1A2 (0.50) GSRSMN1; SMN2CD274PDCD1ALDH1A1
SCHEMBL29912778 0.75 USP28 (0.40) GSRSMN1; SMN2CD274ALDH1A1USP28
SCHEMBL4574283 0.75 USP28 (0.40) GSRSMN1; SMN2CD274ALDH1A1USP28
SCHEMBL15587609 0.73 GSR (0.47) GSRSMN1; SMN2CD274PDCD1MEN1
SCHEMBL23803596 0.73 THRB (0.42)
SCHEMBL29220938 0.72 GSR (0.50) GSRSMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL29037434 0.72 GSR (0.55) GSRSMN1; SMN2CD274PDCD1ALDH1A1
SCHEMBL4599034 0.72 CHRM2 (0.64) SMN1; SMN2CD274PDCD1ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7618960-B2 Morpholine type cinnamide compound EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-11-17 US disclosed
EP-1953154-A1 MORPHOLINE TYPE CINNAMIDE COMPOUND Eisai R&D Management Co., Ltd. (JP) 2008-08-06 EP disclosed
US-20070117798-A1 Morpholine type cinnamide compound EISAI R&D MANAGEMENT CO., LTD. 2007-05-24 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-20070117798-A1 Morpholine type cinnamide compound MLX, XDH, NOX4 GSR 2103/4885SMN1; SMN2 642/4885CD274 3969/4885

“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.