SCHEMBL9817543

SCHEMBL9817543

CCCCCCCCCCc1ccccc1-c1ccccc1C#N

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 1/20 0.47
NR1H2 P55055 1/20 0.47
NR1H3 Q13133 1/20 0.47
TSHR P16473 2/20 0.41
HSD17B10 Q99714 1/20 0.41
GPR3 P46089 1/20 0.40
PTPN1 P18031 1/20 0.39
CYSLTR2 Q9NS75 4/20 0.38
CYSLTR1 Q9Y271 4/20 0.38
BID P55957 2/20 0.38
BCL2L1 Q07817 2/20 0.38
MCL1 Q07820 2/20 0.38
BAK1 Q16611 2/20 0.38

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
SCHEMBL1641623 1.00 LIPG (0.47) LIPGNR1H2NR1H3TSHRHSD17B10
SCHEMBL15063660 1.00 LIPG (0.47) LIPGNR1H2NR1H3TSHRHSD17B10
SCHEMBL317339 1.00 LIPG (0.47) LIPGNR1H2NR1H3TSHRHSD17B10
SCHEMBL365485 0.98 LIPG (0.45) LIPGNR1H2NR1H3TSHRHSD17B10
SCHEMBL28715432 0.97 LIPG (0.44) LIPGNR1H2NR1H3TSHRHSD17B10
SCHEMBL14302123 0.93 TSHR (0.41) LIPGNR1H2NR1H3TSHR
SCHEMBL27920563 0.88 LIPG (0.41) LIPGNR1H2NR1H3TSHRHSD17B10
SCHEMBL3629719 0.86 LIPG (0.53) LIPGNR1H2NR1H3TSHRHSD17B10
SCHEMBL6956286 0.86 LIPG (0.53) LIPGNR1H2NR1H3TSHRHSD17B10
SCHEMBL6685317 0.86 LIPG (0.53) LIPGNR1H2NR1H3TSHRHSD17B10

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
JP-61281193-A None JP disclosed
EP-0187533-B1 LIQUID CRYSTAL DISPLAY APPARATUS SONY CORPORATION (JP) 1991-10-02 EP disclosed
JP-S61281193-A LIQUID CRYSTAL NEC CORP 1986-12-11 JP disclosed
EP-0187533-A2 Liquid crystal display apparatus SONY CORPORATION (JP) 1986-07-16 EP disclosed