SCHEMBL24543468

SCHEMBL24543468

CC(C)(C)C1=CC(=CN=Nc2c(Cl)cccc2Cl)C=C(C(C)(C)C)C1=O

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.35
▸ HSP90AA1 P07900 1/20 0.35
▸ KMT2A Q03164 3/20 0.35
▸ ATM Q13315 2/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ GPR35 Q9HC97 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ HSD11B1 P28845 3/20 0.34
▸ MEN1 O00255 2/20 0.32
▸ ALDH1A1 P00352 2/20 0.30
▸ CES2 O00748 1/20 0.30
▸ PKM P14618 1/20 0.30
▸ HPGD P15428 1/20 0.30
▸ CES1 P23141 1/20 0.30
▸ MPI P34949 1/20 0.30
▸ NPSR1 Q6W5P4 1/20 0.30
▸ MAPK1 P28482 1/20 0.30
▸ TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL13580308 0.86 ATM (0.35) MAPTKMT2AATMNPC1GPR35
SCHEMBL18877731 0.86 KMT2A (0.35) MAPTKMT2AATMNPC1GPR35
SCHEMBL18877733 0.84 SMN1; SMN2 (0.43) MAPTKMT2AATMNPC1GPR35
SCHEMBL13580320 0.82 ATM (0.34) MAPTKMT2AATMNPC1GPR35
SCHEMBL13580400 0.80 NPC1 (0.32) KMT2AATMNPC1GPR35
SCHEMBL13580415 0.80 ATM (0.33) MAPTKMT2AATMNPC1GPR35
SCHEMBL18877729 0.80 KMT2A (0.37) MAPTKMT2AATMNPC1GPR35
SCHEMBL13580315 0.80 NPC1 (0.33) KMT2AATMNPC1GPR35
SCHEMBL18877776 0.79 NPC1 (0.30) KMT2AATMNPC1GPR35
SCHEMBL141575 0.78 ATM (0.36) MAPTHSP90AA1KMT2AATMNPC1

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
US-20220197161-A1 ELECTROPHOTOGRAPHIC PHOTOCONDUCTOR, METHOD OF MANUFACTURING THE SAME, AND ELECTROPHOTOGRAPHIC EQUIPMENT FUJI ELECTRIC CO., LTD. (JP) 2022-06-23 — — US disclosed
Send feedback