SCHEMBL25009031

SCHEMBL25009031

N#Cc1ccc(Cl)c(C(=O)Cl)n1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SOS2 Q07890 1/20 0.37
PDE4A P27815 1/20 0.34
PDE4B Q07343 1/20 0.34
PDE4C Q08493 1/20 0.34
PDE4D Q08499 1/20 0.34
CTSB P07858 2/20 0.33
ALDH1A1 P00352 2/20 0.33
SRC P12931 1/20 0.33
KMO O15229 1/20 0.33
IDO1 P14902 1/20 0.33
P2RX7 Q99572 1/20 0.32
EIF4E P06730 1/20 0.32
NQO1 P15559 1/20 0.32
S1PR1 P21453 1/20 0.32
S1PR3 Q99500 1/20 0.32
GRM4 Q14833 1/20 0.31
MEN1 O00255 1/20 0.31
GAA P10253 1/20 0.31
KMT2A Q03164 1/20 0.31
AHR P35869 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
SCHEMBL25010840 0.85 MEN1 (0.42) SOS2PDE4APDE4BPDE4CPDE4D
SCHEMBL239212 0.79 KDM4E (0.45) PDE4APDE4BPDE4CPDE4DALDH1A1
SCHEMBL25009978 0.78 KMT2A (0.36) SOS2CTSBALDH1A1SRCNQO1
SCHEMBL9720893 0.75 ALDH1A1 (0.49) ALDH1A1MEN1GAAKMT2A
SCHEMBL29497605 0.75 CNR1 (0.40) PDE4APDE4BPDE4CPDE4DALDH1A1
SCHEMBL26624901 0.75 CNR1 (0.40) PDE4APDE4BPDE4CPDE4DALDH1A1
SCHEMBL14966226 0.75 MAPT (0.48) PDE4AALDH1A1MEN1GAAKMT2A
SCHEMBL7846050 0.73 SOS2 (0.38) SOS2ALDH1A1SRCKMONQO1
SCHEMBL25841907 0.72 KMT2A (0.41) ALDH1A1P2RX7MEN1KMT2A
SCHEMBL2792945 0.71 KDM4E (0.38) SOS2ALDH1A1KMONQO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4380928-A1 PPARG INVERSE AGONISTS AND USES THEREOF Flare Therapeutics Inc. (US) 2024-06-12 EP disclosed
WO-2023014861-A1 PPARG INVERSE AGONISTS AND USES THEREOF FLARE THERAPEUTICS INC. (US) 2023-02-09 WO disclosed
WO-2023014861-A1 PPARG INVERSE AGONISTS AND USES THEREOF FLARE THERAPEUTICS INC. (US) 2023-02-09 WO disclosed