SCHEMBL20199121

SCHEMBL20199121

CSNCCNc1nonc1/C(=N/O)Nc1ccc(F)c(Br)c1

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 19/20 0.52
TDO2 P48775 3/20 0.48
IDO2 Q6ZQW0 3/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2C9 P11712 1/20 0.48
HDAC1 Q13547 1/20 0.47

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
SCHEMBL19015025 0.91 IDO1 (0.54) IDO1TDO2IDO2CYP3A4CYP2C9
SCHEMBL20199032 0.90 IDO1 (0.50) IDO1TDO2IDO2CYP3A4CYP2C9
SCHEMBL19133468 0.89 IDO1 (0.52) IDO1TDO2IDO2CYP3A4CYP2C9
SCHEMBL19158107 0.89 IDO1 (0.52) IDO1TDO2IDO2CYP3A4CYP2C9
SCHEMBL20653587 0.89 IDO1 (0.54) IDO1TDO2IDO2CYP3A4CYP2C9
SCHEMBL20199267 0.88 IDO1 (0.48) IDO1CYP3A4CYP2C9
SCHEMBL20199153 0.87 IDO1 (0.49) IDO1TDO2IDO2CYP3A4CYP2C9
SCHEMBL20199308 0.87 IDO1 (0.52) IDO1TDO2IDO2CYP3A4CYP2C9
SCHEMBL30141305 0.86 IDO1 (0.67) IDO1TDO2IDO2CYP3A4CYP2C9
SCHEMBL20090679 0.86 IDO1 (0.67) IDO1TDO2IDO2CYP3A4CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3560914-A1 SULFONYL AMIDINE AS INDOLEAMINE-2,3-DIOXYGENASE INHIBITOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF Shanghai Longwood Biopharmaceuticals Co., Ltd. (CN) 2019-10-30 EP disclosed
WO-2018095432-A1 SULFOXIMINE, SULFONIMIDAMIDE, SULFONDIIMINE AND DIIMIDOSULFONAMIDE COMPOUNDS AS INHIBITORS OF INDOLEAMINE 2, 3-DIOXYGENASE SHANGHAI FOCHON PHARMACEUTICAL CO., LTD. (CN) 2018-05-31 WO disclosed