SCHEMBL24708463

SCHEMBL24708463

Cc1nn(C(N)=O)cc1N

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.33
ADORA2A P29274 2/20 0.33
ADORA1 P30542 2/20 0.33
KDM4E B2RXH2 1/20 0.33
ADORA3 P0DMS8 1/20 0.33
PKM P14618 1/20 0.33
ADORA2B P29275 1/20 0.33
KAT2B Q92831 1/20 0.33
IKBKB O14920 1/20 0.32
IKBKE Q14164 1/20 0.32
GAA P10253 1/20 0.32
PIM3 Q86V86 2/20 0.31
DAPK3 O43293 1/20 0.31
PRKD3 O94806 1/20 0.31
MAP4K4 O95819 1/20 0.31
PRKACA P17612 1/20 0.31
LTK P29376 1/20 0.31
KDR P35968 1/20 0.31
MAP2K2 P36507 1/20 0.31
MAPK8 P45983 1/20 0.31

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
SCHEMBL15512886 0.83 GAA (0.35) LMNAADORA2AADORA1KDM4EADORA3
SCHEMBL1559563 0.81 LMNA (0.33) LMNAADORA2AADORA1KDM4EADORA3
SCHEMBL28386019 0.79 LMNA (0.33) LMNAADORA2AADORA1KDM4EADORA3
Hydrochloric Acid SCHEMBL20473874 0.79 LMNA (0.33) LMNAADORA2AADORA1KDM4EADORA3
SCHEMBL20988688 0.75 ALDH1A1 (0.31) LMNAADORA2AADORA1KDM4EADORA3
SCHEMBL1559237 0.74 ROCK2 (0.34) KDM4EMAP4K4MAPT
SCHEMBL29187055 0.72 L3MBTL1 (0.36) PKMALDH1A1MAPT
SCHEMBL4537025 0.71 LMNA (0.33) LMNAADORA2AADORA1KDM4EADORA3
SCHEMBL22557846 0.70
SCHEMBL6631083 0.68 POLB (0.41) LMNAKDM4EIKBKBGAAKDR

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
EP-4347032-A1 SUBSTITUTED TETRAHYDROFURAN-2-CARBOXAMIDES AS MODULATORS OF SODIUM CHANNELS Vertex Pharmaceuticals Incorporated (US) 2024-04-10 EP disclosed
CN-117813302-A Substituted tetrahydrofuran-2-carboxamides as sodium channel modulators 沃泰克斯药物股份有限公司 2024-04-02 CN disclosed
WO-2022256702-A1 SUBSTITUTED TETRAHYDROFURAN-2-CARBOXAMIDES AS MODULATORS OF SODIUM CHANNELS VERTEX PHARMACEUTICALS INCORPORATED (US) 2022-12-08 WO disclosed
WO-2022256702-A1 SUBSTITUTED TETRAHYDROFURAN-2-CARBOXAMIDES AS MODULATORS OF SODIUM CHANNELS VERTEX PHARMACEUTICALS INCORPORATED (US) 2022-12-08 WO disclosed