SCHEMBL10340558

SCHEMBL10340558

CCCCCCCCCCCc1cc(C#N)ccc1-c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.50
HSD17B10 Q99714 1/20 0.50
CNR1 P21554 1/20 0.44
CNR2 P34972 1/20 0.44
LIPG Q9Y5X9 1/20 0.43
ADRA2C P18825 1/20 0.43
PTGDR2 Q9Y5Y4 1/20 0.40
CYP19A1 P11511 2/20 0.40
GPR3 P46089 1/20 0.40
KDM4E B2RXH2 2/20 0.39
ALDH1A1 P00352 2/20 0.39
GAA P10253 2/20 0.39
HPGD P15428 2/20 0.39
MEN1 O00255 1/20 0.39
APAF1 O14727 1/20 0.39
USP2 O75604 1/20 0.39
ESR1 P03372 1/20 0.39
MAPT P10636 1/20 0.39
HTT P42858 1/20 0.39
CACNA1B Q00975 1/20 0.39

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
SCHEMBL5697352 1.00 TSHR (0.50) TSHRHSD17B10CNR1CNR2LIPG
SCHEMBL5307030 1.00 TSHR (0.50) TSHRHSD17B10CNR1CNR2LIPG
SCHEMBL9211839 1.00 TSHR (0.50) TSHRHSD17B10CNR1CNR2LIPG
SCHEMBL10340506 1.00 TSHR (0.50) TSHRHSD17B10CNR1CNR2LIPG
SCHEMBL4455682 0.99 TSHR (0.48) TSHRHSD17B10CNR1CNR2LIPG
SCHEMBL28273598 0.94 ADRA2C (0.44) TSHRHSD17B10CNR1CNR2ADRA2C
SCHEMBL31512576 0.92 TSHR (0.44) TSHRHSD17B10CNR1CNR2LIPG
SCHEMBL8376943 0.89 TSHR (0.56) TSHRHSD17B10CNR1CNR2ADRA2C
SCHEMBL30477373 0.88 ADRA2C (0.47) ADRA2CPTGDR2CYP19A1KDM4EALDH1A1
SCHEMBL5925419 0.85 ADRA2C (0.46) TSHRHSD17B10CNR1CNR2LIPG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0144683-B1 ALIGNMENT LAYER ORIENTATION IN LIQUID CRYSTAL DISPLAYS International Business Machines Corporation (US) 1990-01-03 EP disclosed