SCHEMBL25845223

SCHEMBL25845223

CC1(C)c2ccccc2-c2cc(-c3nc(Cl)nc(-c4ccccc4-c4ccccc4)n3)ccc21

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.35
MEN1 O00255 6/20 0.35
KMT2A Q03164 6/20 0.35
HPGD P15428 5/20 0.35
MAPT P10636 5/20 0.35
KDM4E B2RXH2 5/20 0.35
L3MBTL1 Q9Y468 4/20 0.35
TDP1 Q9NUW8 1/20 0.35
RARB P10826 1/20 0.34
RARG P13631 1/20 0.34
RXRA P19793 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
HSD17B10 Q99714 1/20 0.34
LMNA P02545 6/20 0.33
CYP1A2 P05177 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
ADORA3 P0DMS8 1/20 0.31
ALOX15 P16050 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
SCHEMBL21870998 0.93 MEN1 (0.40) ALDH1A1MEN1KMT2AHPGDMAPT
SCHEMBL30934022 0.93 MEN1 (0.40) ALDH1A1MEN1KMT2AHPGDMAPT
SCHEMBL25047375 0.92 MEN1 (0.38) ALDH1A1MEN1KMT2AHPGDMAPT
SCHEMBL21709122 0.92 MEN1 (0.39) ALDH1A1MEN1KMT2AHPGDMAPT
SCHEMBL26937486 0.92 MEN1 (0.41) ALDH1A1MEN1KMT2AHPGDMAPT
SCHEMBL19794480 0.92 PDK2 (0.35) ALDH1A1MEN1KMT2AHPGDMAPT
SCHEMBL23079792 0.89 PDK2 (0.35) ALDH1A1MEN1KMT2AHPGDMAPT
SCHEMBL23697111 0.88 MEN1 (0.40) ALDH1A1MEN1KMT2AHPGDMAPT
SCHEMBL17151711 0.88 MEN1 (0.40) ALDH1A1MEN1KMT2AHPGDMAPT
SCHEMBL23697604 0.88 MEN1 (0.41) ALDH1A1MEN1KMT2AHPGDMAPT

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
WO-2023134228-A1 NITROGEN-CONTAINING COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME, AND ELECTRONIC APPARATUS 陕西莱特光电材料股份有限公司 2023-07-20 WO disclosed