SCHEMBL9656453

SCHEMBL9656453

OC(C=CC(O)c1ccccc1)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.46
MAPK1 P28482 1/20 0.46
TSHR P16473 1/20 0.44
KDM4E B2RXH2 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
ADRA2A P08913 1/20 0.42
ADRA2C P18825 1/20 0.42
HIF1A Q16665 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
ATM Q13315 1/20 0.42
CYP2D6 P10635 1/20 0.42
SRC P12931 1/20 0.42
DPP4 P27487 2/20 0.41
F2 P00734 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
SCHEMBL9656438 1.00 LMNA (0.46) LMNAMAPK1TSHRKDM4EL3MBTL1
SCHEMBL10996466 0.88 LMNA (0.45) LMNAMAPK1TSHRKDM4EADRA2A
SCHEMBL10996469 0.88 LMNA (0.45) LMNAMAPK1TSHRKDM4EADRA2A
SCHEMBL902763 0.87 LMNA (0.41) LMNAMAPK1TSHRKDM4EL3MBTL1
SCHEMBL95469 0.85 MEN1 (0.60) LMNAMAPK1TSHRKDM4EL3MBTL1
SCHEMBL22616865 0.85 MEN1 (0.60) LMNAMAPK1TSHRKDM4EL3MBTL1
SCHEMBL560387 0.85 MEN1 (0.60) LMNAMAPK1TSHRKDM4EL3MBTL1
SCHEMBL477467 0.83 CYP1A2 (0.57) LMNACYP2D6
SCHEMBL10411854 0.83 CYP1A2 (0.52) LMNAMAPK1TSHR
SCHEMBL477645 0.83 CYP1A2 (0.57) LMNACYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5151333-A Containing imine derivative NIPPON ZEON CO., LTD (JP) 1992-09-29 US disclosed
US-3975381-A Process for preparing γ-lactone derivatives SAGAMI CHEMICAL RESEARCH CENTER (JA) 1976-08-17 US disclosed