SCHEMBL29786246

SCHEMBL29786246

CCc1ccc(C(=O)NN=CCCc2ccccc2)cc1

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.61
ALDH1A1 P00352 3/20 0.56
MEN1 O00255 3/20 0.56
KMT2A Q03164 3/20 0.56
HPGD P15428 1/20 0.56
GAA P10253 4/20 0.56
POLB P06746 3/20 0.56
ASF1A Q9Y294 1/20 0.49
HDAC1 Q13547 2/20 0.49
KDM4E B2RXH2 6/20 0.48
MAPT P10636 1/20 0.48
PLK1 P53350 1/20 0.47
HDAC8 Q9BY41 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.45
TRPV1 Q8NER1 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C19 P33261 1/20 0.45
LMNA P02545 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
SCHEMBL10147915 1.00 SMN1; SMN2 (0.61) SMN1; SMN2ALDH1A1MEN1KMT2AHPGD
SCHEMBL4923713 0.90 SMN1; SMN2 (0.69) SMN1; SMN2ALDH1A1MEN1KMT2AHPGD
SCHEMBL4923704 0.90 SMN1; SMN2 (0.69) SMN1; SMN2ALDH1A1MEN1KMT2AHPGD
SCHEMBL2993486 0.83 SMN1; SMN2 (0.61) SMN1; SMN2ALDH1A1MEN1KMT2AGAA
SCHEMBL2993484 0.83 SMN1; SMN2 (0.61) SMN1; SMN2ALDH1A1MEN1KMT2AGAA
SCHEMBL10220038 0.83 SMN1; SMN2 (0.57) SMN1; SMN2ALDH1A1MEN1KMT2AHPGD
SCHEMBL11300020 0.79 GAA (0.74) SMN1; SMN2ALDH1A1KMT2AHPGDGAA
SCHEMBL12838364 0.79 GAA (0.74) SMN1; SMN2ALDH1A1KMT2AHPGDGAA
SCHEMBL4554291 0.79 SMN1; SMN2 (0.62) SMN1; SMN2ALDH1A1MEN1KMT2AHPGD
SCHEMBL25041334 0.77 ESRRG (0.69) SMN1; SMN2ALDH1A1MEN1KMT2AGAA

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-3357904-B1 CHIRAL DIACHYLHYDRAZINE LIGANDS FOR MODULATING THE EXPRESSION OF EXOGENOUS GENES VIA AN ECDYSONE RECEPTOR COMPLEX PRECIGEN INC (US) 2022-07-06 EP disclosed