SCHEMBL12445300

SCHEMBL12445300

CC(C)(C)OC(=O)N1CCC(F)(F)C(F)(F)C1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
EPHX2 P34913 1/20 0.42
HDAC2 Q92769 2/20 0.41
CYP11B2 P19099 1/20 0.41
USP30 Q70CQ3 2/20 0.40
RORC P51449 3/20 0.40
HPGD P15428 1/20 0.40
SCD5 Q86SK9 1/20 0.39
HDAC1 Q13547 1/20 0.39
ACACB O00763 2/20 0.38
RECQL P46063 1/20 0.38

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
SCHEMBL1061211 0.88 USP2 (0.45) USP2SMN1; SMN2EPHX2HDAC2CYP11B2
SCHEMBL12445298 0.87 USP2 (0.48) USP2SMN1; SMN2EPHX2HPGDRECQL
SCHEMBL1604637 0.87 USP2 (0.44) USP2SMN1; SMN2EPHX2HDAC2CYP11B2
SCHEMBL31343939 0.87 USP2 (0.44) USP2SMN1; SMN2EPHX2HDAC2CYP11B2
SCHEMBL25216320 0.85 USP2 (0.42) USP2SMN1; SMN2EPHX2HDAC2CYP11B2
SCHEMBL475749 0.84 USP2 (0.47) USP2SMN1; SMN2EPHX2HDAC2CYP11B2
SCHEMBL30825786 0.83 USP2 (0.44) USP2SMN1; SMN2EPHX2HDAC2CYP11B2
SCHEMBL30396068 0.83 USP2 (0.44) USP2SMN1; SMN2EPHX2HDAC2CYP11B2
SCHEMBL31616252 0.83 HPGD (0.41) USP2SMN1; SMN2EPHX2HDAC2CYP11B2
SCHEMBL23579343 0.83 USP2 (0.47) USP2SMN1; SMN2EPHX2HDAC2CYP11B2

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-8481774-B2 Method for producing tetrafluoro compound NIPPON SODA CO., LTD. (JP) 2013-07-09 US disclosed
US-8481774-B2 Method for producing tetrafluoro compound NIPPON SODA CO., LTD. (JP) 2013-07-09 US disclosed
US-20110178323-A1 METHOD FOR PRODUCING TETRAFLUORO COMPOUND NIPPON SODA CO., LTD. (JP) 2011-07-21 US disclosed
US-20110178323-A1 METHOD FOR PRODUCING TETRAFLUORO COMPOUND NIPPON SODA CO., LTD. (JP) 2011-07-21 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-20110178323-A1 METHOD FOR PRODUCING TETRAFLUORO COMPOUND F9, CA9, TAF9 USP2 4138/4885SMN1; SMN2 3613/4885EPHX2 881/4885

“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.