SCHEMBL10909585

SCHEMBL10909585

CN(C(=O)CN)n1cccc1C(=O)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.47
ALDH1A1 P00352 1/20 0.47
LMNA P02545 1/20 0.47
MAPT P10636 1/20 0.47
ALOX12 P18054 1/20 0.47
RECQL P46063 1/20 0.47
KMT2A Q03164 1/20 0.47
GABRP O00591 1/20 0.43
GABRD O14764 1/20 0.43
GABRA1 P14867 1/20 0.43
GABRB1 P18505 1/20 0.43
GABRG2 P18507 1/20 0.43
GABRB3 P28472 1/20 0.43
GABRA5 P31644 1/20 0.43
GABRA3 P34903 1/20 0.43
GABRA2 P47869 1/20 0.43
GABRB2 P47870 1/20 0.43
GABRA4 P48169 1/20 0.43
GABRE P78334 1/20 0.43
GABRA6 Q16445 1/20 0.43

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
Fumaric Acid SCHEMBL10366170 0.94 GABRP (0.42) MEN1ALDH1A1LMNAMAPTALOX12
SCHEMBL10365808 0.86 MAPT (0.47) MEN1ALDH1A1LMNAMAPTALOX12
SCHEMBL10365911 0.83 ALDH1A1 (0.49) MEN1ALDH1A1LMNAMAPTALOX12
SCHEMBL10907186 0.81 CNR2 (0.45) MEN1ALDH1A1LMNARECQLKMT2A
SCHEMBL10907133 0.81 ALDH1A1 (0.36) MEN1ALDH1A1MAPTKMT2AGABRP
Bromide SCHEMBL10365280 0.80 CNR2 (0.44) MEN1ALDH1A1LMNARECQLKMT2A
SCHEMBL10366284 0.73 ALDH1A1 (0.46) MEN1ALDH1A1LMNAMAPTALOX12
SCHEMBL10366286 0.73 MEN1 (0.46) MEN1ALDH1A1LMNAMAPTALOX12
SCHEMBL10909334 0.70 CYP1A2 (0.51) MEN1ALDH1A1LMNAMAPTALOX12
SCHEMBL10909576 0.70 ALDH1A1 (0.44) MEN1ALDH1A1LMNAMAPTALOX12

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-4588727-A ANALGESICS, TRANQUILLIZERS, ANTICONVULSANTS HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1986-05-13 US claimed