SCHEMBL7476741

SCHEMBL7476741

CN(C)C(=O)C(=O)c1c[nH]c2ccc(Br)cc12

nearest known ligand 0.61

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 1/20 0.61
GABRA1 P14867 1/20 0.50
GABRB1 P18505 1/20 0.50
GABRA3 P34903 1/20 0.50
GABRB2 P47870 1/20 0.50
MTNR1A P48039 1/20 0.45
MTNR1B P49286 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
SLC6A4 P31645 1/20 0.45
GPR84 Q9NQS5 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
SCHEMBL5434549 0.86 NR4A2 (0.69) NR4A2GABRA1GABRB1GABRA3GABRB2
SCHEMBL29805074 0.85 NR4A2 (0.64) NR4A2GABRA1GABRB1GABRA3GABRB2
SCHEMBL5176370 0.82 HPGD (0.46) NR4A2
SCHEMBL30622613 0.82 KDM4E (0.55) MTNR1AMTNR1BSMN1; SMN2SLC6A4GPR84
SCHEMBL24243764 0.82 KDM4E (0.55) MTNR1AMTNR1BSMN1; SMN2SLC6A4GPR84
SCHEMBL31127577 0.81 NR4A2 (0.63) NR4A2GABRA1GABRB1GABRA3GABRB2
SCHEMBL1557691 0.81 NR4A2 (0.63) NR4A2GABRA1GABRB1GABRA3GABRB2
SCHEMBL8917164 0.81 NR4A2 (0.50) NR4A2GABRA1GABRB1GABRA3GABRB2
SCHEMBL31748335 0.80 NR4A2 (0.61) NR4A2GABRA1GABRB1GABRA3GABRB2
SCHEMBL1558405 0.80 NR4A2 (0.61) NR4A2GABRA1GABRB1GABRA3GABRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0975594-B1 PROCESS FOR THE PRODUCTION OF INDOLE DERIVATIVES PFIZER LTD (GB) 2002-09-18 EP disclosed
US-6281357-B1 HEADACHE THERAPY PFIZER INC 2001-08-28 US disclosed
EP-0975594-A1 PROCESS FOR THE PRODUCTION OF INDOLE DERIVATIVES Pfizer Limited (GB) 2000-02-02 EP disclosed
WO-1999002493-A1 PROCESS FOR THE PRODUCTION OF INDOLE DERIVATIVES PFIZER LIMITED (GB) 1999-01-21 WO disclosed