SCHEMBL20199267

SCHEMBL20199267

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

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 15/20 0.48
SMN1; SMN2 Q16637 2/20 0.39
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
TSHR P16473 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 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
SCHEMBL20199121 0.88 IDO1 (0.52) IDO1CYP3A4CYP2C9
SCHEMBL20199192 0.88 MEN1 (0.48) IDO1SMN1; SMN2TSHRMEN1KMT2A
SCHEMBL20199153 0.87 IDO1 (0.49) IDO1CYP3A4CYP2C9
SCHEMBL19900662 0.86 IDO1 (0.51) IDO1CYP3A4CYP2C9
SCHEMBL19900660 0.86 IDO1 (0.51) IDO1CYP3A4CYP2C9
SCHEMBL19661023 0.86 IDO1 (0.51) IDO1CYP3A4CYP2C9
SCHEMBL20199306 0.85 IDO1 (0.41) IDO1CYP3A4CYP2C9
SCHEMBL21188374 0.85 IDO1 (0.65) IDO1SMN1; SMN2CYP1A2CYP3A4CYP2D6
SCHEMBL19465774 0.84 IDO1 (0.58) IDO1CYP3A4CYP2C9
SCHEMBL146606 0.84 IDO1 (0.58) IDO1CYP3A4CYP2C9

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
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