SCHEMBL9153579

SCHEMBL9153579

CN(C(=O)CN(C(=O)CN)c1ccccc1)c1ccc(F)c(F)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
POLB P06746 1/20 0.40
HTT P42858 1/20 0.40
GABRP O00591 1/20 0.38
GABRD O14764 1/20 0.38
GABRA1 P14867 1/20 0.38
GABRB1 P18505 1/20 0.38
GABRG2 P18507 1/20 0.38
GABRB3 P28472 1/20 0.38
GABRA5 P31644 1/20 0.38
GABRA3 P34903 1/20 0.38
GABRA2 P47869 1/20 0.38
GABRB2 P47870 1/20 0.38
GABRA4 P48169 1/20 0.38
GABRE P78334 1/20 0.38
GABRA6 Q16445 1/20 0.38
GABRG1 Q8N1C3 1/20 0.38
GABRG3 Q99928 1/20 0.38
GABRQ Q9UN88 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
SCHEMBL9153519 0.86 SLC6A2 (0.41) KMT2AMEN1POLBLTB4R2AOC3
SCHEMBL9152131 0.85 MAPT (0.42) KMT2APOLQALDH1A1GLATSHR
SCHEMBL8860046 0.85 KMT2A (0.46) KMT2AMEN1POLQADRA2CAOC3
SCHEMBL9152678 0.83 HTR3E (0.48) KMT2AHTTGABRPGABRDGABRA1
SCHEMBL9156475 0.83 DRD4 (0.48) KMT2AMEN1POLBGABRPGABRD
SCHEMBL9154159 0.82 GABRP (0.41) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL9153457 0.82 RAB9A (0.42) KMT2AMEN1POLQAOC3ALDH1A1
SCHEMBL9158562 0.82 GABRP (0.39) KMT2AMEN1POLBGABRPGABRD
SCHEMBL9153600 0.80 ALDH1A1 (0.45) KMT2AMEN1POLBALDH1A1TSHR
SCHEMBL9154411 0.80 GABRP (0.41) GABRPGABRDGABRA1GABRB1GABRG2

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