SCHEMBL9634041

SCHEMBL9634041

CCCCCCCCCCCCOc1ccc(-c2ccccc2)c(C#N)c1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 5/20 0.51
PTPN1 P18031 1/20 0.51
LTA4H P09960 1/20 0.48
SOAT1 P35610 1/20 0.47
HDAC8 Q9BY41 1/20 0.46
ALDH1A1 P00352 3/20 0.46
HPGD P15428 3/20 0.46
KDM4E B2RXH2 2/20 0.46
HTT P42858 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
PDK2 Q15119 1/20 0.45
TSHR P16473 1/20 0.44
PLA2G4B P0C869 1/20 0.44
MAOB P27338 1/20 0.43

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
SCHEMBL4257516 1.00 PTPN11 (0.51) PTPN11PTPN1LTA4HSOAT1HDAC8
SCHEMBL11573787 0.99 PTPN1 (0.52) PTPN11PTPN1LTA4HSOAT1HDAC8
SCHEMBL10582938 0.90 MAOB (0.47) PTPN11PTPN1HDAC8PDK2MAOB
SCHEMBL8826120 0.85 ALDH1A1 (0.48) PTPN11ALDH1A1HPGDKDM4EHTT
SCHEMBL4257509 0.83 KDM4E (0.54) PTPN11LTA4HALDH1A1HPGDKDM4E
SCHEMBL9634048 0.83 KDM4E (0.54) PTPN11LTA4HALDH1A1HPGDKDM4E
SCHEMBL9633314 0.83 KDM4E (0.55) PTPN11PTPN1LTA4HSOAT1HDAC8
SCHEMBL5057429 0.83 PTPN1 (0.61) PTPN11PTPN1LTA4HSOAT1HDAC8
SCHEMBL11573789 0.82 KDM4E (0.52) PTPN1LTA4HALDH1A1HPGDKDM4E
SCHEMBL11429810 0.81 ALDH1A1 (0.57) LTA4HALDH1A1HPGDKDM4EHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0294724-B1 DISPLAY MATERIAL SONY CORPORATION (JP) 1992-05-20 EP disclosed
US-4940689-A Display material SONY CORPORATION (JP) 1990-07-10 US disclosed
EP-0294724-A2 Display material SONY CORPORATION (JP) 1988-12-14 EP disclosed