SCHEMBL31190826

SCHEMBL31190826

Fc1cc(Cl)c2cn[nH]c2c1

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 6/20 0.53
NOS1 P29475 3/20 0.50
MET P08581 1/20 0.41
IDO1 P14902 3/20 0.39
TDO2 P48775 1/20 0.39
DYRK1A Q13627 1/20 0.37
CYP1A2 P05177 2/20 0.35
ALOX15 P16050 1/20 0.35

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
SCHEMBL30403358 0.79 METAP2 (0.56) METAP2METIDO1TDO2CYP1A2
SCHEMBL3538351 0.79 METAP2 (0.56) METAP2METIDO1TDO2CYP1A2
SCHEMBL14487466 0.79 METAP2 (0.56) METAP2NOS1IDO1TDO2DYRK1A
SCHEMBL7909516 0.76 METAP2 (0.53) METAP2NOS1METIDO1TDO2
SCHEMBL3513796 0.76 METAP2 (0.53) METAP2METIDO1TDO2
SCHEMBL29793852 0.76 METAP2 (0.53) METAP2NOS1METIDO1TDO2
SCHEMBL16618130 0.76 IDO1 (0.61) METAP2NOS1IDO1TDO2DYRK1A
SCHEMBL30860872 0.76 IDO1 (0.61) METAP2METIDO1TDO2CYP1A2
SCHEMBL7572191 0.76 NOS1 (0.50) METAP2NOS1IDO1TDO2DYRK1A
SCHEMBL29410369 0.76 IDO1 (0.61) METAP2NOS1IDO1TDO2DYRK1A

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-2024220747-A2 FLUORINATED CYCLIC DERIVATIVES OF SULFONAMIDES AND SULFONES, AND COMPOSITIONS AND METHODS THEREOF Lysoway Therapeutics, Inc. (US) 2024-10-24 WO disclosed