SCHEMBL4002333

SCHEMBL4002333

Fc1cccc(C(F)(F)Br)c1F

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.39
CES2 O00748 2/20 0.38
CES1 P23141 2/20 0.38
BCHE P06276 1/20 0.38
BACE1 P56817 1/20 0.31
SLC22A12 Q96S37 1/20 0.31
KCNN4 O15554 2/20 0.31
PDK2 Q15119 1/20 0.31
P2RX7 Q99572 1/20 0.31
SLC6A2 P23975 1/20 0.31
SLC6A4 P31645 1/20 0.31
SLC6A3 Q01959 1/20 0.31
MPL P40238 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
SCHEMBL448487 0.82 HSD11B1 (0.47) HSD11B1CES2CES1BCHESLC22A12
SCHEMBL29551965 0.82 HSD11B1 (0.47) HSD11B1CES2CES1BCHESLC22A12
SCHEMBL1600455 0.79 KCNN4 (0.41) HSD11B1CES2CES1SLC22A12KCNN4
SCHEMBL30757407 0.79 KCNN4 (0.41) HSD11B1CES2CES1SLC22A12KCNN4
SCHEMBL3972408 0.78 HSD11B1 (0.38) HSD11B1CES2CES1BCHEBACE1
SCHEMBL1201504 0.78 CES2 (0.41) HSD11B1CES2CES1BCHEBACE1
SCHEMBL10779525 0.78 HSD11B1 (0.38) HSD11B1CES2CES1BCHEBACE1
SCHEMBL2968190 0.78 HSD11B1 (0.38) HSD11B1CES2CES1BCHEBACE1
SCHEMBL2965656 0.78 CES2 (0.41) HSD11B1CES2CES1BCHEBACE1
SCHEMBL28478290 0.78 HSD11B1 (0.38) HSD11B1CES2CES1BCHEKCNN4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114195799-A Pyrazine derivative and application thereof in inhibition of SHP2 勤浩医药(苏州)有限公司 2022-03-18 CN disclosed
EP-1883619-B1 PROCESS OF PREPARATION OF SUBSTITUTED TETRAFLUOROBENZYLANILINE COMPOUND AND ITS PHARMACEUTICALLY APPROVED SALTS CHOONGWAE PHARMA CORP (KR) 2013-03-20 EP disclosed
US-7495126-B2 Process of preparation of substituted tetrafluorobenzylaniline compound and its pharmaceutically approved salts CHOONGWAE PHARMA CORPORATION (KR) 2009-02-24 US disclosed
US-20080167492-A1 Process of Preparation of Substituted Tetrafluorobenzylaniline Compound and Its Pharmaceutically Approved Salts CHOONGWAE PHARMA CORPORATION (KR) 2008-07-10 US disclosed
EP-1883619-A1 PROCESS OF PREPARATION OF SUBSTITUTED TETRAFLUOROBENZYLANILINE COMPOUND AND ITS PHARMACEUTICALLY APPROVED SALTS Choongwae Pharma Corporation (KR) 2008-02-06 EP disclosed
WO-2006126846-A1 PROCESS OF PREPARATION OF SUBSTITUTED TETRAFLUOROBENZYLANILINE COMPOUND AND ITS PHARMACEUTICALLY APPROVED SALTS CHOONGWAE PHARMA CORPORATION (KR) 2006-11-30 WO disclosed
US-20050192359-A1 N-biphenylamides and fungicidal compositions containing the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2005-09-01 US disclosed
EP-1486483-A1 N-BIPHENYLAMIDES AND FUNGICIDAL COMPOSITIONS CONTAINING THE SAME Sumitomo Chemical Company, Limited (JP) 2004-12-15 EP 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-20050192359-A1 N-biphenylamides and fungicidal compositions containing the same CBR3, ARNT, CBR1 HSD11B1 2461/4885CES2 1280/4885CES1 1297/4885
US-20080167492-A1 Process of Preparation of Substituted Tetrafluorobenzylaniline Compound and Its Pharmaceutically Approved Salts IL5, CYP3A5, PGA5 HSD11B1 1755/4885CES2 3381/4885CES1 4330/4885

“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.