SCHEMBL29009241

SCHEMBL29009241

CCc1ccc(-n2c3ccc(CC)cc3c3cc(CC)ccc32)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGR P06401 1/20 0.42
RORA P35398 1/20 0.42
RORC P51449 1/20 0.42
RORB Q92753 1/20 0.42
MGLL Q99685 1/20 0.41
APOBEC3G Q9HC16 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
KDM4E B2RXH2 3/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
ALDH1A1 P00352 4/20 0.39
HPGD P15428 4/20 0.39
MAPT P10636 3/20 0.39
TSHR P16473 2/20 0.39
LMNA P02545 2/20 0.39
THRB P10828 1/20 0.39
ALOX12 P18054 1/20 0.39
HTT P42858 1/20 0.39
HSD17B10 Q99714 2/20 0.39
TRPA1 O75762 1/20 0.38

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
SCHEMBL30434963 1.00 PGR (0.42) PGRRORARORCRORBMGLL
SCHEMBL28019409 0.89 MAPT (0.42) PGRRORARORCRORBMGLL
SCHEMBL13368077 0.89 KDM4E (0.50) PGRRORARORCRORBMGLL
SCHEMBL10067484 0.88 MAPT (0.40) PGRRORARORCRORBAPOBEC3G
SCHEMBL10067482 0.87 TDP1 (0.41) PGRRORARORCRORBMGLL
SCHEMBL24797393 0.85 ALDH1A1 (0.47) PGRRORARORCRORBMGLL
SCHEMBL31092495 0.85 DNM1 (0.40) MGLLAPOBEC3GTDP1KDM4ENPC1
SCHEMBL16268823 0.85 KDM4E (0.47) PGRRORARORCRORBTDP1
SCHEMBL24452290 0.85 ALDH1A1 (0.39) PGRRORARORCRORBMGLL
SCHEMBL21077110 0.84 KDM4E (0.50) PGRRORARORCRORBAPOBEC3G

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-116178678-A Bridged electron donor-acceptor polymer and preparation method and application thereof 中山大学 2023-05-30 CN disclosed