SCHEMBL8978770

SCHEMBL8978770

CCCCc1ccc(C#Cc2cc(F)c(C#Cc3ccc(CC)cc3)cc2F)cc1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 1/20 0.39
PTPRO Q16827 1/20 0.39
FFAR1 O14842 6/20 0.39
FFAR4 Q5NUL3 2/20 0.39
HSD17B10 Q99714 2/20 0.39
TSHR P16473 1/20 0.39
TAAR1 Q96RJ0 1/20 0.38
HTR2A P28223 1/20 0.38
CYP2A6 P11509 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
RARB P10826 2/20 0.36
RARA P10276 1/20 0.36
RARG P13631 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HPGD P15428 1/20 0.36

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
SCHEMBL8978776 0.95 HSD17B10 (0.44) PTPN11PTPROFFAR1FFAR4HSD17B10
SCHEMBL8979018 0.95 HSD17B10 (0.41) PTPN11PTPROFFAR1FFAR4HSD17B10
SCHEMBL8978751 0.94 HSD17B10 (0.47) PTPN11PTPROFFAR1FFAR4HSD17B10
SCHEMBL8978849 0.94 HSD17B10 (0.47) PTPN11PTPROFFAR1FFAR4HSD17B10
SCHEMBL8978825 0.94 HSD17B10 (0.47) PTPN11PTPROFFAR1FFAR4HSD17B10
SCHEMBL8978910 0.94 HSD17B10 (0.47) PTPN11PTPROFFAR1FFAR4HSD17B10
SCHEMBL8979041 0.94 HSD17B10 (0.47) PTPN11PTPROFFAR1FFAR4HSD17B10
SCHEMBL8978819 0.92 HSD17B10 (0.46) PTPN11PTPROFFAR1FFAR4HSD17B10
SCHEMBL8978759 0.92 PTPN11 (0.40) PTPN11PTPROFFAR1FFAR4HSD17B10
SCHEMBL8979199 0.91 FFAR1 (0.43) PTPN11PTPROFFAR1FFAR4HSD17B10

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-0581272-B1 Tolane derivatives, liquid crystal compositions containing the derivatives and liquid crystal display device using the compositions SEIKO EPSON CORP (JP) 1996-05-08 EP disclosed
US-5356558-A Compatibility, high speed response SEIKO EPSON CORPORATION (JP) 1994-10-18 US disclosed
EP-0581272-A1 Tolane derivatives, liquid crystal compositions containing the derivatives and liquid crystal display device using the compositions SEIKO EPSON CORPORATION (JP) 1994-02-02 EP disclosed