SCHEMBL4878669

SCHEMBL4878669

Fc1ccccc1C(F)(F)F.OBO

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KCNN4 O15554 5/20 0.41
SLC22A12 Q96S37 2/20 0.41
KIF11 P52732 1/20 0.39
LMNA P02545 1/20 0.39
GAA P10253 1/20 0.39
ALDH1A1 P00352 2/20 0.39
POLB P06746 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
NFKB1 P19838 1/20 0.38
KAT6A Q92794 1/20 0.38
HSD11B1 P28845 1/20 0.38
PTGS2 P35354 1/20 0.37
KCNE1 P15382 1/20 0.37
KCNQ1 P51787 1/20 0.37
CA2 P00918 1/20 0.36
IDO1 P14902 1/20 0.36

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
SCHEMBL169053 0.90 SLC22A12 (0.46) KCNN4SLC22A12KIF11LMNAGAA
SCHEMBL29466225 0.90 SLC22A12 (0.46) KCNN4SLC22A12KIF11LMNAGAA
Hydrochloric Acid SCHEMBL28030629 0.87 ALDH1A1 (0.48) KCNN4SLC22A12KIF11LMNAGAA
Bromide SCHEMBL27721879 0.87 SLC22A12 (0.44) KCNN4SLC22A12KIF11LMNAGAA
Ammonia Solution, Strong SCHEMBL2163470 0.87 SLC22A12 (0.44) KCNN4SLC22A12KIF11LMNAGAA
SCHEMBL5486293 0.85 GAA (0.45) KIF11LMNAGAAALDH1A1POLB
Formaldehyde SCHEMBL28254541 0.83 SLC22A12 (0.46) KCNN4SLC22A12LMNAGAAALDH1A1
Methylamine SCHEMBL27811451 0.83 ALDH1A1 (0.45) KCNN4SLC22A12KIF11ALDH1A1POLB
Isothiocyanate SCHEMBL27973963 0.77 SLC22A12 (0.39) KCNN4SLC22A12KIF11ALDH1A1POLB
SCHEMBL27687338 0.77 SLC22A12 (0.50) KCNN4SLC22A12KIF11LMNAGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105985319-B Aryl phthalazine compound and its preparation method and application 复旦大学 2019-02-26 CN disclosed
CN-106281356-A Fluorinated liquid crystal containing difluoro-methoxy bridged bond and diyl and combinations thereof thing 福建省邵武市永晶化工有限公司 2017-01-04 CN disclosed
CN-106244168-A Fluorinated liquid crystal containing difluoro-methoxy bridged bond and polyfluoro xenyl and combinations thereof thing 福建永晶科技有限公司 2016-12-21 CN disclosed
US-9493478-B2 Fused ring compound containing furan or salt thereof and pharmaceutical composition comprising same YUHAN CORPORATION (KR) 2016-11-15 US disclosed
CN-104449762-B Fluorine-containing liquid crystal containing difluoromethoxy bridge bond and composition thereof 福建省邵武市永晶化工有限公司 2016-09-14 CN disclosed
US-20150191478-A1 FUSED RING COMPOUND CONTAINING FURAN OR SALT THEREOF AND PHARMACEUTICAL COMPOSITION COMPRISING SAME YUHAN CORPORATION (KR) 2015-07-09 US disclosed
EP-2876109-A1 FUSED RING COMPOUND CONTAINING FURAN OR SALT THEREOF AND PHARMACEUTICAL COMPOSITION COMPRISING SAME Yuhan Corporation (KR) 2015-05-27 EP disclosed
US-20080076771-A1 Thrombopoietin Receptor Agonists REITER LAWRENCE A 2008-03-27 US disclosed
EP-1794156-A2 TROMBOPOIETIN RECEPTOR AGONISTS Pfizer Products Incorporated (US) 2007-06-13 EP disclosed
WO-2006033005-A2 THROMBOPOIETIN RECEPTOR AGONISTS PFIZER PRODUCTS INC. (US) 2006-03-30 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-20150191478-A1 FUSED RING COMPOUND CONTAINING FURAN OR SALT THEREOF AND PHARMACEUTICAL COMPOSITION COMPRISING SAME PIK3CD, PIK3CA, MTOR KCNN4 920/4885SLC22A12 2121/4885KIF11 3806/4885
US-20080076771-A1 Thrombopoietin Receptor Agonists MPL, THPO, TBXA2R KCNN4 4029/4885SLC22A12 3578/4885KIF11 4100/4885

“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.