SCHEMBL20101606

SCHEMBL20101606

C=C(c1ccc(O)cc1)c1cccc(C(=O)c2ccc(C(C)(C)C)cc2)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIRT1 Q96EB6 1/20 0.55
SRD5A2 P31213 1/20 0.49
SMN1; SMN2 Q16637 3/20 0.46
LMNA P02545 3/20 0.46
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
TYR P14679 1/20 0.46
HTT P42858 3/20 0.44
CNR1 P21554 1/20 0.44
CNR2 P34972 1/20 0.44
KCNK9 Q9NPC2 1/20 0.43
ATM Q13315 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
MAPT P10636 3/20 0.43
PKM P14618 2/20 0.43
ESR1 P03372 1/20 0.43
ESR2 Q92731 1/20 0.43
GFER P55789 1/20 0.43
HSD17B10 Q99714 1/20 0.43

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
SCHEMBL21867671 0.91 SIRT1 (0.65) SIRT1SRD5A2SMN1; SMN2LMNAMEN1
SCHEMBL2748306 0.84 KCNK9 (0.47) SIRT1SRD5A2SMN1; SMN2LMNAMEN1
SCHEMBL30924444 0.82 SIRT1 (0.65) SIRT1SRD5A2SMN1; SMN2MEN1KMT2A
SCHEMBL21230531 0.81 SIRT1 (0.56) SIRT1SRD5A2SMN1; SMN2LMNAMEN1
SCHEMBL23396621 0.81 SRD5A2 (0.70) SIRT1SRD5A2SMN1; SMN2LMNATYR
SCHEMBL7482370 0.81 SRD5A2 (0.70) SIRT1SRD5A2SMN1; SMN2LMNATYR
SCHEMBL10395127 0.78 LMNA (0.71) SRD5A2SMN1; SMN2LMNAMEN1KMT2A
SCHEMBL698836 0.78 LMNA (0.71) SRD5A2SMN1; SMN2LMNAMEN1KMT2A
SCHEMBL10938928 0.78 MAPT (0.71) LMNAMEN1KMT2ATYRHTT
SCHEMBL19160290 0.77 KCNK9 (0.42) SIRT1SRD5A2SMN1; SMN2LMNAMEN1

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
WO-2018077967-A1 FLUOROPOLYMER LAMINATE FOR THERMOFORMING INTO VEHICLES BODY PANELS SOLVAY SPECIALTY POLYMERS USA, LLC (US) 2018-05-03 WO disclosed