SCHEMBL25103100

SCHEMBL25103100

CCn1cc2c(Br)ccc(C(=O)OC)c2n1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.51
ALDH1A1 P00352 5/20 0.51
MEN1 O00255 3/20 0.51
KMT2A Q03164 3/20 0.51
NPC1 O15118 7/20 0.43
SMN1; SMN2 Q16637 6/20 0.43
GAA P10253 2/20 0.43
LMNA P02545 1/20 0.42
HTT P42858 3/20 0.42
NR4A2 P43354 1/20 0.41
RAB9A P51151 5/20 0.40
MAPT P10636 2/20 0.40
BRD4 O60885 1/20 0.40
POLB P06746 2/20 0.39
TSHR P16473 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
HSD17B10 Q99714 1/20 0.38
MAPK1 P28482 1/20 0.38
TDP1 Q9NUW8 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL25105273 0.86 KDM4E (0.41) KDM4EALDH1A1MEN1KMT2ANPC1
SCHEMBL25103101 0.85 NPC1 (0.42) KDM4EALDH1A1MEN1KMT2ANPC1
SCHEMBL25104712 0.83 KDM4E (0.45) KDM4EALDH1A1MEN1KMT2ANPC1
SCHEMBL30158309 0.82 KMT2A (0.36) KDM4EALDH1A1MEN1KMT2ANPC1
SCHEMBL25103104 0.82 KDM4E (0.40) KDM4EALDH1A1MEN1KMT2ANPC1
SCHEMBL25104556 0.82 KDM4E (0.41) KDM4EALDH1A1MEN1KMT2ANPC1
SCHEMBL25102855 0.78 KDM4E (0.38) KDM4EALDH1A1MEN1KMT2AGAA
SCHEMBL25103276 0.77 KDM4E (0.42) KDM4EALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL25104074 0.76 PDE4D (0.40) KDM4EALDH1A1MEN1KMT2ANR4A2
SCHEMBL543331 0.76 ALDH1A1 (0.46) KDM4EALDH1A1MEN1KMT2ANPC1

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-4395892-A1 COMPOUNDS AND METHODS FOR MODULATING SPLICING Remix Therapeutics Inc. (US) 2024-07-10 EP disclosed
WO-2023034812-A1 COMPOUNDS AND METHODS FOR MODULATING SPLICING REMIX THERAPEUTICS INC. (US) 2023-03-09 WO disclosed
EP-4110459-A1 HETEROCYCLIC AMIDES AND THEIR USE FOR MODULATING SPLICING Remix Therapeutics Inc. (US) 2023-01-04 EP disclosed