SCHEMBL8666436

SCHEMBL8666436

FC(F)(F)c1ccc2c(c1)SN=C(n1ccnc1)N2

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
MEN1 O00255 1/20 0.37
LMNA P02545 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
MAPT P10636 1/20 0.37
CYP2C9 P11712 1/20 0.37
MAPK1 P28482 1/20 0.37
CYP2C19 P33261 1/20 0.37
PMP22 Q01453 1/20 0.37
KMT2A Q03164 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
TBXAS1 P24557 2/20 0.36
CRBN Q96SW2 2/20 0.36
PDE3B Q13370 1/20 0.36
PDE3A Q14432 1/20 0.36
KIF11 P52732 2/20 0.36
NOX1 Q9Y5S8 2/20 0.36
CYBB P04839 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
SCHEMBL8526054 0.79 CD38 (0.32) CYP3A4TBXAS1CRBNPDE3BPDE3A
SCHEMBL8584026 0.76 MEN1 (0.36) ALDH1A1MEN1LMNACYP1A2CYP3A4
SCHEMBL7952055 0.74 ALDH1A1 (0.42) ALDH1A1MEN1LMNACYP1A2CYP3A4
SCHEMBL12391451 0.66 ALDH1A1 (0.57) ALDH1A1MEN1LMNACYP1A2CYP3A4
SCHEMBL709619 0.66 LMNA (0.58) ALDH1A1MEN1LMNACYP1A2CYP3A4
SCHEMBL25025011 0.65 IDO1 (0.60) ALDH1A1MEN1LMNACYP1A2CYP3A4
SCHEMBL15011268 0.65 ALDH1A1 (0.50) ALDH1A1MEN1LMNACYP1A2CYP3A4
SCHEMBL31053840 0.65 IDO1 (0.60) ALDH1A1MEN1LMNACYP1A2CYP3A4
SCHEMBL2935531 0.65 ALDH1A1 (0.66) ALDH1A1MEN1LMNACYP1A2CYP3A4
SCHEMBL6618970 0.65 CRBN (0.36) CRBN

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
CN-1081633-C 1,2, 4-benzothiadiazine derivatives, method for preparing same and use thereof NOVO NORDISK AS (DK) 2002-03-27 CN disclosed
CN-1222910-A 1,2, 4-benzothiadiazine derivatives, method for preparing same and use thereof NOVO NORDISK AS (DK) 1999-07-14 CN disclosed
EP-0906297-A1 1,2,4-BENZOTHIADIAZINE DERIVATIVES, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1999-04-07 EP disclosed
WO-1997049692-A1 1,2,4-BENZOTHIADIAZINE DERIVATIVES, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1997-12-31 WO disclosed