SCHEMBL9156475

SCHEMBL9156475

CN(C(=O)CN(C(=O)CN)c1ccccc1)c1ccc(Cl)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 1/20 0.48
KMT2A Q03164 3/20 0.47
MEN1 O00255 2/20 0.47
GABRP O00591 1/20 0.45
GABRD O14764 1/20 0.45
GABRA1 P14867 1/20 0.45
GABRB1 P18505 1/20 0.45
GABRG2 P18507 1/20 0.45
GABRB3 P28472 1/20 0.45
GABRA5 P31644 1/20 0.45
GABRA3 P34903 1/20 0.45
GABRA2 P47869 1/20 0.45
GABRB2 P47870 1/20 0.45
GABRA4 P48169 1/20 0.45
GABRE P78334 1/20 0.45
GABRA6 Q16445 1/20 0.45
GABRG1 Q8N1C3 1/20 0.45
GABRG3 Q99928 1/20 0.45
GABRQ Q9UN88 1/20 0.45
POLQ O75417 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
SCHEMBL8860046 0.91 KMT2A (0.46) KMT2AMEN1POLQALDH1A1AOC3
SCHEMBL9153457 0.89 RAB9A (0.42) KMT2AMEN1POLQLMNAL3MBTL1
SCHEMBL9152678 0.86 HTR3E (0.48) KMT2AGABRPGABRDGABRA1GABRB1
SCHEMBL9152131 0.86 MAPT (0.42) KMT2APOLQALDH1A1KDM4EHSD17B10
SCHEMBL9155738 0.84 LMNA (0.46) LMNAPOLB
SCHEMBL9153579 0.83 KMT2A (0.40) KMT2AMEN1GABRPGABRDGABRA1
SCHEMBL9152749 0.82 GABRP (0.44) KMT2AMEN1GABRPGABRDGABRA1
SCHEMBL9134297 0.82 POLB (0.46) DRD4KMT2AMEN1GABRPGABRD
SCHEMBL7500313 0.82 AOC3 (0.50) DRD4KMT2AMEN1GABRPGABRD
Hydrochloric Acid SCHEMBL9868189 0.80 AOC3 (0.51) DRD4KMT2AMEN1GABRPGABRD

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-5382590-A Gastrointestinal disorders and nervous system disorders RHONE-POULENC RORER S.A. (FR) 1995-01-17 US disclosed