SCHEMBL10429707

SCHEMBL10429707

C=CCc1cc(-c2ccccc2)ccc1-c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 4/20 0.52
GABRB2 P47870 4/20 0.52
AKR1B1 P15121 1/20 0.44
MEN1 O00255 2/20 0.41
MAPT P10636 2/20 0.41
KMT2A Q03164 2/20 0.41
ALOX5 P09917 2/20 0.41
CNR2 P34972 2/20 0.41
POLB P06746 1/20 0.41
GAA P10253 1/20 0.41
GABRB1 P18505 1/20 0.41
RXRA P19793 1/20 0.41
CNR1 P21554 1/20 0.41
GABRA5 P31644 1/20 0.41
GABRA3 P34903 1/20 0.41
GABRA2 P47869 1/20 0.41
ACE2 Q9BYF1 1/20 0.41
SIRT3 Q9NTG7 1/20 0.41
DCLRE1A Q6PJP8 1/20 0.41
DCLRE1B Q9H816 1/20 0.41

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
SCHEMBL27889218 0.92 GABRA1 (0.53) GABRA1GABRB2AKR1B1MEN1MAPT
SCHEMBL28541485 0.85 GABRA1 (0.47) GABRA1GABRB2AKR1B1MEN1MAPT
SCHEMBL5406886 0.85 GABRA1 (0.55) GABRA1GABRB2AKR1B1MEN1MAPT
SCHEMBL27889219 0.84 GABRA1 (0.56) GABRA1GABRB2AKR1B1MEN1MAPT
SCHEMBL27886719 0.82 GABRA1 (0.47) GABRA1GABRB2AKR1B1MEN1MAPT
Biphenyl SCHEMBL7928631 0.82 DPP4 (0.52) GABRA1GABRB2AKR1B1KMT2AL3MBTL1
SCHEMBL9307517 0.82 ALOX5 (0.53) GABRA1GABRB2AKR1B1MEN1MAPT
SCHEMBL31738460 0.82 PSMB5 (0.39) GABRA1GABRB2AKR1B1MEN1MAPT
SCHEMBL170787 0.80 DPP4 (0.54) GABRA1GABRB2AKR1B1KMT2ADPP4
SCHEMBL2185735 0.80 GABRA1 (0.82) GABRA1GABRB2AKR1B1MEN1MAPT

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-0360042-A1 p-Terphenyl derivatives and liquid crystalline compositions KANTO KAGAKU KABUSHIKI KAISHA (JP) 1990-03-28 EP disclosed