SCHEMBL8034339

SCHEMBL8034339

[NH]c1ccccc1C(=O)OC1CC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN1A P35498 5/20 0.47
SCN2A Q99250 5/20 0.47
SCN3A Q9NY46 5/20 0.47
PTPN2 P17706 2/20 0.46
PTPN1 P18031 2/20 0.46
ALDH1A1 P00352 2/20 0.46
PTPRF P10586 1/20 0.46
KDM4E B2RXH2 1/20 0.46
POLB P06746 1/20 0.46
TSHR P16473 1/20 0.46
HSD17B10 Q99714 1/20 0.46
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
SERPINE1 P05121 1/20 0.41
LMNA P02545 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 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
SCHEMBL208341 0.86 TSHR (0.53) SCN1ASCN2ASCN3APTPN2PTPN1
SCHEMBL1263672 0.79 ALDH1A1 (0.54) SCN1ASCN2ASCN3APTPN2PTPN1
SCHEMBL23275566 0.79 MMP9 (0.53) SCN1ASCN2ASCN3APTPN2PTPN1
SCHEMBL3361977 0.79 MEN1 (0.55) SCN1ASCN2ASCN3APTPN2PTPN1
SCHEMBL27871119 0.78 ALDH1A1 (0.73) SCN1ASCN2ASCN3APTPN2PTPN1
SCHEMBL27929943 0.78 SCN1A (0.50) SCN1ASCN2ASCN3APTPN2PTPN1
SCHEMBL7993233 0.78 CES2 (0.50) SCN1ASCN2ASCN3APTPN2PTPN1
SCHEMBL8607117 0.77 MEN1 (0.57) SCN1ASCN2ASCN3APTPN2PTPN1
SCHEMBL19668120 0.77 MEN1 (0.57) SCN1ASCN2ASCN3APTPN2PTPN1
SCHEMBL10707097 0.77 MEN1 (0.57) SCN1ASCN2ASCN3APTPN2PTPN1

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-6143694-A AIDING RIPENING OF TOBACCO PLANT BY PREHARVEST APPLICATION OF NON-PHYTOTOXIC AMOUNT OF 2-(4,5-DIHYDRO-4-METHYL-4-(1-METHYLETHYL)-5-OXO-1H-IMIDAZOL-2 -YL)ARYLCARBOXYLATE TAYLOR JOHN B (US) 2000-11-07 US claimed