SCHEMBL7783672

SCHEMBL7783672

NN=c1[nH]c2ccccc2n(-c2ccc(Cl)cc2)c1=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.43
HTT P42858 2/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
ADORA3 P0DMS8 4/20 0.42
GABRP O00591 1/20 0.40
GABRD O14764 1/20 0.40
GABRA1 P14867 1/20 0.40
GABRB1 P18505 1/20 0.40
GABRG2 P18507 1/20 0.40
GABRB3 P28472 1/20 0.40
GABRA5 P31644 1/20 0.40
GABRA3 P34903 1/20 0.40
GABRA2 P47869 1/20 0.40
GABRB2 P47870 1/20 0.40
GABRA4 P48169 1/20 0.40
GABRE P78334 1/20 0.40
GABRA6 Q16445 1/20 0.40
GABRG1 Q8N1C3 1/20 0.40

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
SCHEMBL7782299 0.88 PDE7A (0.45) LMNAMEN1KMT2AL3MBTL1ADORA3
SCHEMBL23119669 0.77 LMNA (0.67) LMNAHTTMEN1KMT2AL3MBTL1
SCHEMBL8888752 0.77 TSHR (0.40) LMNAHTTMEN1KMT2AL3MBTL1
SCHEMBL7782330 0.73 PSMB8 (0.47) LMNAHTTMEN1KMT2AADORA3
SCHEMBL6977596 0.69 KDM4E (0.73) LMNAHTTMEN1KMT2AL3MBTL1
SCHEMBL3150851 0.67 PDE7A (0.51) LMNAMEN1KMT2AL3MBTL1ADORA3
SCHEMBL30910102 0.67 PDE7A (0.51) LMNAMEN1KMT2AL3MBTL1ADORA3
SCHEMBL5667519 0.67 TSHR (0.42) LMNAMEN1KMT2AL3MBTL1KDM4E
SCHEMBL5361973 0.67 TSHR (0.42) LMNAMEN1KMT2AL3MBTL1KDM4E
SCHEMBL6283505 0.67 PDE7A (0.77) HTTMEN1KMT2AL3MBTL1KDM4E

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0809635-B1 ALPHA-SUBSTITUTED HYDRAZIDES HAVING CALPAIN INHIBITORY ACTIVITY WARNER LAMBERT CO (US) 2001-10-04 EP claimed
EP-0809635-A1 ALPHA-SUBSTITUTED HYDRAZIDES HAVING CALPAIN INHIBITORY ACTIVITY WARNER-LAMBERT COMPANY (US) 1997-12-03 EP claimed
WO-1996025403-A1 α-SUBSTITUTED HYDRAZIDES HAVING CALPAIN INHIBITORY ACTIVITY WARNER-LAMBERT COMPANY (US) 1996-08-22 WO claimed
EP-0809635-B1 ALPHA-SUBSTITUTED HYDRAZIDES HAVING CALPAIN INHIBITORY ACTIVITY WARNER LAMBERT CO (US) 2001-10-04 EP disclosed
EP-0809635-A1 ALPHA-SUBSTITUTED HYDRAZIDES HAVING CALPAIN INHIBITORY ACTIVITY WARNER-LAMBERT COMPANY (US) 1997-12-03 EP disclosed
WO-1996025403-A1 α-SUBSTITUTED HYDRAZIDES HAVING CALPAIN INHIBITORY ACTIVITY WARNER-LAMBERT COMPANY (US) 1996-08-22 WO disclosed