SCHEMBL10902015

SCHEMBL10902015

O=C(O)COc1ccc2cc3cc4ccccc4cc3cc2c1

nearest known ligand 0.89

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN7 P35236 2/20 0.89
ALOX15 P16050 2/20 0.62
MEN1 O00255 6/20 0.58
KMT2A Q03164 6/20 0.58
PPARG P37231 2/20 0.58
NCOA2 Q15596 2/20 0.58
NCOA1 Q15788 2/20 0.58
NCOA3 Q9Y6Q9 2/20 0.58
HTT P42858 2/20 0.58
NPSR1 Q6W5P4 1/20 0.58
NR2E3 Q9Y5X4 1/20 0.58
NCOR2 Q9Y618 1/20 0.58
POLB P06746 2/20 0.56
FFAR1 O14842 1/20 0.56
RAB9A P51151 3/20 0.55
LMNA P02545 2/20 0.54
ALDH1A1 P00352 1/20 0.54
MAPT P10636 1/20 0.54
PTPN12 Q05209 1/20 0.54
HPGD P15428 2/20 0.54

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
SCHEMBL25640 0.94 PTPN7 (1.00) PTPN7ALOX15MEN1KMT2APPARG
SCHEMBL29367022 0.94 PTPN7 (1.00) PTPN7ALOX15MEN1KMT2APPARG
SCHEMBL15201762 0.93 PTPN7 (0.96) PTPN7ALOX15MEN1KMT2APPARG
SCHEMBL15201765 0.93 PTPN7 (0.96) PTPN7ALOX15MEN1KMT2APPARG
SCHEMBL4076964 0.90 PTPN7 (0.85) PTPN7ALOX15MEN1KMT2APPARG
Ethylene Glycol SCHEMBL9493499 0.89 PTPN7 (0.90) PTPN7ALOX15MEN1KMT2APPARG
Toluene SCHEMBL5468703 0.86 PTPN7 (0.84) PTPN7ALOX15MEN1KMT2APPARG
SCHEMBL30439696 0.82 PTPN7 (0.72) PTPN7MEN1KMT2APPARGNCOA2
SCHEMBL9750825 0.82 PTPN7 (0.72) PTPN7ALOX15MEN1KMT2APPARG
SCHEMBL10344678 0.82 PTPN7 (0.72) PTPN7MEN1KMT2APPARGNCOA2

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-4617151-A 2- or 2,3-substituted 5,6,11,12-tetrathiotetracene and 5,6,11,12-tetraselenotetracene CIBA-GEIGY CORPORATION (US) 1986-10-14 US disclosed