SCHEMBL25876505

SCHEMBL25876505

CC(=O)c1ccc(C)c(NC2=CC(=O)c3ccccc3C2=O)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
STAT3 P40763 1/20 0.53
KMT2A Q03164 6/20 0.52
MEN1 O00255 5/20 0.52
RAB9A P51151 4/20 0.52
NPC1 O15118 3/20 0.52
MAP2K7 O14733 1/20 0.50
MAPT P10636 6/20 0.48
HTT P42858 4/20 0.48
SMN1; SMN2 Q16637 4/20 0.48
LMNA P02545 3/20 0.48
MAPK1 P28482 2/20 0.48
ALDH1A1 P00352 2/20 0.48
S100A4 P26447 2/20 0.48
NFKB1 P19838 1/20 0.48
NFKB2 Q00653 1/20 0.48
RELA Q04206 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
HKDC1 Q2TB90 4/20 0.47
TDP2 O95551 4/20 0.47
BLM P54132 3/20 0.47

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
SCHEMBL25882776 0.90 MAP2K7 (0.63) STAT3KMT2AMEN1RAB9ANPC1
SCHEMBL6350632 0.77 MAPT (0.59) STAT3KMT2AMEN1RAB9ANPC1
SCHEMBL30991488 0.74 RAB9A (0.79) STAT3KMT2AMEN1RAB9ANPC1
SCHEMBL29249534 0.74 RAB9A (0.79) STAT3KMT2AMEN1RAB9ANPC1
SCHEMBL16297243 0.72 MAPT (0.64) KMT2AMEN1RAB9ANPC1MAP2K7
SCHEMBL15906854 0.72 RAB9A (0.68) KMT2AMEN1RAB9ANPC1MAP2K7
SCHEMBL30704433 0.72 CYP19A1 (0.47) KMT2AMEN1RAB9ANPC1MAP2K7
SCHEMBL15765691 0.70 PRKCI (0.59) KMT2AMEN1RAB9ANPC1MAPT
SCHEMBL29633221 0.70 MAPT (0.77) KMT2AMEN1RAB9ANPC1MAP2K7
SCHEMBL28736228 0.70 MAPT (0.77) KMT2AMEN1RAB9ANPC1MAP2K7

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
EP-4215526-A1 CARBONYL HETEROCYCLIC COMPOUND AND APPLICATION THEREOF Shanghai Pharmaceuticals Holding Co., Ltd. (CN) 2023-07-26 EP disclosed