SCHEMBL29135041

SCHEMBL29135041

Clc1cc(-c2ccccc2)ccc1-c1cc(-c2ccc(-c3ccccc3)cc2)nc(-c2ccccc2)n1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 9/20 0.54
KMT2A Q03164 9/20 0.54
HPGD P15428 8/20 0.54
ALDH1A1 P00352 7/20 0.54
MAPT P10636 6/20 0.54
NTSR1 P30989 1/20 0.54
L3MBTL1 Q9Y468 2/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
KDM4E B2RXH2 4/20 0.47
LMNA P02545 2/20 0.47
GLA P06280 1/20 0.47
TDP1 Q9NUW8 2/20 0.47
ADORA2A P29274 2/20 0.47
ADORA1 P30542 2/20 0.47
MAOB P27338 2/20 0.47
CTRC Q99895 1/20 0.46
ESR2 Q92731 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
RXFP1 Q9HBX9 1/20 0.44
CYP2C19 P33261 1/20 0.44

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
SCHEMBL29134686 0.94 MEN1 (0.49) MEN1KMT2AHPGDALDH1A1MAPT
SCHEMBL29242859 0.88 MEN1 (0.56) MEN1KMT2AHPGDALDH1A1MAPT
SCHEMBL25825179 0.88 KMT2A (0.56) MEN1KMT2AHPGDALDH1A1MAPT
SCHEMBL30854734 0.88 KMT2A (0.56) MEN1KMT2AHPGDALDH1A1MAPT
SCHEMBL30854757 0.88 KMT2A (0.56) MEN1KMT2AHPGDALDH1A1MAPT
SCHEMBL25298830 0.88 KMT2A (0.56) MEN1KMT2AHPGDALDH1A1MAPT
SCHEMBL29134695 0.84 ESR2 (0.48) MEN1KMT2AHPGDALDH1A1MAPT
SCHEMBL29892964 0.84 KMT2A (0.57) MEN1KMT2AHPGDALDH1A1MAPT
SCHEMBL22582681 0.84 KMT2A (0.57) MEN1KMT2AHPGDALDH1A1MAPT
SCHEMBL10051312 0.82 MEN1 (0.76) MEN1KMT2AHPGDALDH1A1MAPT

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
CN-117343102-A Compound, organic electroluminescent device and display device SK株式会社 2024-01-05 CN disclosed