SCHEMBL21662313

SCHEMBL21662313

CC(C)(C)c1ccc(Oc2ccc(C(c3ccc(Oc4ccc(N5C(=O)C6CC7C(=O)N(C(C)(C)C)C(=O)C7CC6C5=O)cc4)cc3)(C(F)(F)F)C(F)(F)F)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.34
ALDH1A1 P00352 3/20 0.34
RAB9A P51151 2/20 0.34
HPGD P15428 2/20 0.34
NPC1 O15118 1/20 0.34
MAPT P10636 1/20 0.34
MAPK1 P28482 1/20 0.34
MEN1 O00255 3/20 0.33
L3MBTL1 Q9Y468 1/20 0.32
NPBWR1 P48145 1/20 0.32
MCHR1 Q99705 1/20 0.32
LMNA P02545 3/20 0.31
PPARG P37231 1/20 0.31
PPARA Q07869 1/20 0.31
HTT P42858 1/20 0.31
BLM P54132 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
TDP1 Q9NUW8 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
SCHEMBL21662314 0.84 L3MBTL1 (0.32) KMT2AL3MBTL1
SCHEMBL24802724 0.81 KMT2A (0.32) KMT2AALDH1A1RAB9ALMNA
SCHEMBL18823084 0.73 CA9 (0.48) KMT2AALDH1A1RAB9ANPC1MAPT
SCHEMBL16201615 0.73 LMNA (0.40) KMT2AALDH1A1MAPTMEN1NPBWR1
SCHEMBL17721622 0.72 LMNA (0.45) KMT2AALDH1A1RAB9AHPGDMAPT
SCHEMBL19264893 0.72 AR (0.35) KMT2ARAB9AMEN1LMNASMN1; SMN2
SCHEMBL19264795 0.71 TSHR (0.39) KMT2AALDH1A1RAB9ANPC1MEN1
SCHEMBL13472599 0.70 LMNA (0.43) KMT2AALDH1A1MAPTMEN1LMNA
SCHEMBL94319 0.70 MGLL (0.60) KMT2AALDH1A1HPGDMAPK1MEN1
SCHEMBL8766700 0.70 MGLL (0.53) KMT2AALDH1A1HPGDMAPK1MEN1

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-3604389-A1 POLYIMIDE, POLYIMIDE SOLUTION, AND POLYIMIDE FILM Mitsubishi Gas Chemical Company, Inc. (JP) 2020-02-05 EP disclosed