SCHEMBL10989727

SCHEMBL10989727

CN1CCS/C1=N/C(=O)Nc1c(Br)cccc1Br

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GRM5 P41594 7/20 0.61
▸ ALDH1A1 P00352 3/20 0.34
▸ LMNA P02545 2/20 0.34
▸ KMT2A Q03164 3/20 0.34
▸ MEN1 O00255 2/20 0.34
▸ NPC1 O15118 7/20 0.34
▸ RAB9A P51151 7/20 0.34
▸ KDM4E B2RXH2 3/20 0.34
▸ MAPT P10636 2/20 0.34
▸ TSHR P16473 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ ALOX15 P16050 1/20 0.33
▸ CASP1 P29466 1/20 0.33
▸ CASP7 P55210 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ RECQL P46063 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ GRM1 Q13255 1/20 0.31
▸ FTO Q9C0B1 1/20 0.31

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
SCHEMBL10989729 1.00 GRM5 (0.61) GRM5ALDH1A1LMNAKMT2AMEN1
SCHEMBL10993126 0.85 GRM5 (0.62) GRM5ALDH1A1LMNAKMT2AMEN1
SCHEMBL10993124 0.85 GRM5 (0.62) GRM5ALDH1A1LMNAKMT2AMEN1
SCHEMBL11001113 0.85 GRM5 (0.53) GRM5ALDH1A1KMT2AMEN1NPC1
SCHEMBL10989017 0.84 GRM5 (0.68) GRM5ALDH1A1KMT2AMEN1NPC1
SCHEMBL10996903 0.84 GRM5 (0.61) GRM5ALDH1A1KMT2ANPC1RAB9A
SCHEMBL10996908 0.84 GRM5 (0.61) GRM5ALDH1A1KMT2ANPC1RAB9A
SCHEMBL10989034 0.84 GRM5 (0.68) GRM5ALDH1A1KMT2AMEN1NPC1
SCHEMBL10993280 0.84 GRM5 (0.44) GRM5ALDH1A1LMNAKMT2AMEN1
SCHEMBL10995246 0.83 GRM5 (0.60) GRM5ALDH1A1KMT2AMEN1RAB9A

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-4542144-A EPILEPSY MCNEILAB INC. (US) 1985-09-17 — — US claimed
Send feedback