SCHEMBL6661830

SCHEMBL6661830

CCCCCCCCOc1cccc(-c2ccccc2-c2cccc(OC(OCCCCC)[C@H](CC)OC)c2)c1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 5/20 0.43
TSHR P16473 1/20 0.42
SMPD1 P17405 3/20 0.40
PDK2 Q15119 1/20 0.39
PLA2G4B P0C869 2/20 0.38
CYSLTR2 Q9NS75 3/20 0.38
CYSLTR1 Q9Y271 3/20 0.38
CYP1A2 P05177 1/20 0.37
CYP19A1 P11511 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
THRA P10827 1/20 0.37
THRB P10828 1/20 0.37

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
SCHEMBL6656879 0.93 PTPN11 (0.44) PTPN11TSHRSMPD1PDK2PLA2G4B
SCHEMBL6657967 0.93 PTPN11 (0.44) PTPN11TSHRSMPD1PDK2PLA2G4B
SCHEMBL6657216 0.93 PTPN11 (0.44) PTPN11TSHRSMPD1PDK2PLA2G4B
SCHEMBL6662788 0.87 KMT2A (0.40)
SCHEMBL6661829 0.85 PTPN11 (0.45) PTPN11TSHRPLA2G4B
SCHEMBL6659337 0.83 PTGS2 (0.41) PTPN11TSHRSMPD1CYP1A2CYP19A1
SCHEMBL6655589 0.82 PTPN11 (0.38) PTPN11TSHRPDK2THRATHRB
SCHEMBL6656143 0.81 POLM (0.41)
SCHEMBL6657963 0.78 PTPN11 (0.47) PTPN11TSHRPLA2G4B
SCHEMBL6675268 0.78 PTPN11 (0.47) PTPN11TSHRPLA2G4B

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-1160233-B1 Novel terphenyl compounds SHARP KK (JP) 2004-07-21 EP claimed
EP-1160233-A2 Novel terphenyl compounds SHARP KABUSHIKI KAISHA (JP) 2001-12-05 EP claimed
EP-1160233-B1 Novel terphenyl compounds SHARP KK (JP) 2004-07-21 EP disclosed
EP-1160233-A2 Novel terphenyl compounds SHARP KABUSHIKI KAISHA (JP) 2001-12-05 EP disclosed