SCHEMBL18288348

SCHEMBL18288348

CC(=C(F)F)N1CCOCC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.50
CA12 O43570 3/20 0.41
CA1 P00915 3/20 0.41
CA9 Q16790 3/20 0.41
CA2 P00918 2/20 0.41
PKM P14618 1/20 0.41
FAAH O00519 1/20 0.39
PHGDH O43175 1/20 0.39
ALDH1A1 P00352 1/20 0.39
ALDH2 P05091 1/20 0.39
PDK1 Q15118 1/20 0.39
PDK2 Q15119 1/20 0.39
PDK3 Q15120 1/20 0.39
MGLL Q99685 1/20 0.39
MEN1 O00255 1/20 0.38
TP53 P04637 1/20 0.38
KMT2A Q03164 1/20 0.38
HTT P42858 1/20 0.38
TSHR P16473 1/20 0.38
MMP1 P03956 1/20 0.37

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
SCHEMBL18860290 0.79 SMN1; SMN2 (0.54) SMN1; SMN2CA12CA1CA9CA2
SCHEMBL18288367 0.76 ALDH1A1 (0.35) SMN1; SMN2CA12CA1CA9CA2
SCHEMBL27442057 0.75 SMN1; SMN2 (0.50) SMN1; SMN2CA12CA1CA9CA2
SCHEMBL19016208 0.75 SMN1; SMN2 (0.50) SMN1; SMN2CA12CA1CA9CA2
SCHEMBL11026574 0.75 SMN1; SMN2 (0.50) SMN1; SMN2CA12CA1CA9CA2
SCHEMBL22693864 0.74 ALDH1A1 (0.38) SMN1; SMN2CA12CA1CA9CA2
SCHEMBL20319191 0.74 CA12 (0.44) SMN1; SMN2CA12CA1CA9CA2
SCHEMBL17629714 0.74 CA12 (0.44) SMN1; SMN2CA12CA1CA9CA2
SCHEMBL1266163 0.73
SCHEMBL13437473 0.71 SMN1; SMN2 (0.46) SMN1; SMN2CA12CA1CA9CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3303435-B1 HYDROFLUOROOLEFINS AND METHODS OF USING SAME 3M INNOVATIVE PROPERTIES CO (US) 2020-11-25 EP disclosed
EP-3390464-B1 AQUEOUS DISPERSIONS OF AMINE-CONTAINING FLUORINATED POLYMERS AND METHODS OF MAKING AND USING THE SAME 3M INNOVATIVE PROPERTIES CO (US) 2020-10-21 EP disclosed
US-20200291144-A1 Amine-Containing Polymers, Dispersions Thereof and Methods of Making and Using the Same 3M INNOVATIVE PROPERTIES COMPANY 2020-09-17 US disclosed
US-10738001-B2 Hydrofluoroolefins and methods of using same 3M INNOVATIVE PROPERTIES COMPANY (US) 2020-08-11 US disclosed
US-10703833-B2 Amine-containing polymers, dispersions thereof and methods of making and using the same 3M INNOVATIVE PROPERTIES COMPANY (US) 2020-07-07 US disclosed
US-20180141893-A1 HYDROFLUOROOLEFINS AND METHODS OF USING SAME 3M INNOVATIVE PROPERTIES COMPANY (US) 2018-05-24 US disclosed
US-20180141893-A1 HYDROFLUOROOLEFINS AND METHODS OF USING SAME 3M INNOVATIVE PROPERTIES COMPANY (US) 2018-05-24 US disclosed
WO-2017106119-A1 AMINE-CONTAINING POLYMERS, DISPERSIONS THEREOF AND METHODS OF MAKING AND USING THE SAME 3M INNOVATIVE PROPERTIES COMPANY (US) 2017-06-22 WO disclosed
WO-2016196240-A1 HYDROFLUOROOLEFINS AND METHODS OF USING SAME 3M INNOVATIVE PROPERTIES COMPANY (US) 2016-12-08 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 (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-20180141893-A1 HYDROFLUOROOLEFINS AND METHODS OF USING SAME RFC3, RFC2, RFC1 SMN1; SMN2 1966/4885CA12 1746/4885CA1 2229/4885
US-10738001-B2 Hydrofluoroolefins and methods of using same RFC3, RFC2, RFC1 SMN1; SMN2 1966/4885CA12 1746/4885CA1 2229/4885

“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.