SCHEMBL28034993

SCHEMBL28034993

FC(F)(F)c1ccccc1Cl.[MgH2]

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNN4 O15554 1/20 0.46
HSD11B1 P28845 1/20 0.46
LMNA P02545 1/20 0.45
TSHR P16473 1/20 0.45
ALDH1A1 P00352 1/20 0.41
POLB P06746 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CYP19A1 P11511 1/20 0.41
AR P10275 1/20 0.41
P2RX7 Q99572 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
KCNJ5 P48544 1/20 0.39
KCNJ3 P48549 1/20 0.39
IDO1 P14902 3/20 0.39
PYCR1 P32322 1/20 0.39
HTR3E A5X5Y0 1/20 0.38
HTR3B O95264 1/20 0.38
HTR3A P46098 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
SCHEMBL29467226 0.97 KCNN4 (0.48) KCNN4HSD11B1LMNATSHRALDH1A1
SCHEMBL5966718 0.97 KCNN4 (0.48) KCNN4HSD11B1LMNATSHRALDH1A1
SCHEMBL117692 0.97 KCNN4 (0.48) KCNN4HSD11B1LMNATSHRALDH1A1
SCHEMBL5607381 0.95 KCNN4 (0.46) KCNN4HSD11B1LMNATSHRALDH1A1
Benzene SCHEMBL29136712 0.95 KCNN4 (0.52) KCNN4HSD11B1LMNATSHRALDH1A1
SCHEMBL29057192 0.95 KCNN4 (0.46) KCNN4HSD11B1LMNATSHRALDH1A1
Ammonia Solution, Strong SCHEMBL15562823 0.95 KCNN4 (0.46) KCNN4HSD11B1LMNATSHRALDH1A1
SCHEMBL4463108 0.95 KCNN4 (0.46) KCNN4HSD11B1LMNATSHRALDH1A1
SCHEMBL27901573 0.92 KCNN4 (0.45) KCNN4HSD11B1LMNATSHRALDH1A1
Methylamine SCHEMBL27920487 0.90 KCNN4 (0.48) KCNN4HSD11B1LMNATSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104995199-A Method for producing tetrakis (fluoroaryl) borate ALBEMARLE CORP 2015-10-21 CN disclosed