SCHEMBL7170306

SCHEMBL7170306

CCCCCCCOc1ccc(-c2ccccc2C(=O)O)cc1NC(C)=O

nearest known ligand 0.73

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 8/20 0.73
PTPN1 P18031 4/20 0.52
PTPN6 P29350 1/20 0.48
PLK1 P53350 1/20 0.47
IDO1 P14902 2/20 0.46
S1PR3 Q99500 1/20 0.46

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
SCHEMBL27245989 0.85 PTPN11 (1.00) PTPN11PTPN1PTPN6S1PR3
SCHEMBL3184382 0.85 PTPN11 (0.55) PTPN11IDO1
SCHEMBL8181779 0.82 PTPN11 (0.68) PTPN11PTPN1PTPN6
SCHEMBL7170404 0.82 PTPN11 (0.80) PTPN11PTPN1PTPN6S1PR3
SCHEMBL8178709 0.80 CREBBP (0.60) PTPN11
SCHEMBL7172420 0.80 AKR1C3 (0.53) PTPN11PTPN1PLK1S1PR3
SCHEMBL7166121 0.78 PTPN11 (0.73) PTPN11PTPN1PTPN6S1PR3
SCHEMBL11482525 0.77 KMT2A (0.64) PTPN1
SCHEMBL14625066 0.77 KMT2A (0.64) PTPN1
SCHEMBL7952997 0.77 KMT2A (0.64) PTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6569504-B1 Dimers of LC-like compounds in which the monomers are linked to each other through a high birefringence moiety (dimerization linker) DISPLAYTECH, INC. 2003-05-27 US disclosed
US-6139771-A USEFUL IN ELECTOOPTICAL AND NON-LINEAR OPTICAL APPLICATIONS DISPLAYTECH, INC. (US) 2000-10-31 US disclosed