SCHEMBL9820571

SCHEMBL9820571

Cc1cc(Br)c(O)c(C(=O)C2CCCCC2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
BCL2L1 Q07817 1/20 0.40
PLAU P00749 2/20 0.39
F2 P00734 1/20 0.39
F10 P00742 1/20 0.39
PLG P00747 1/20 0.39
PLAT P00750 1/20 0.39
KMT2A Q03164 3/20 0.39
GAA P10253 1/20 0.39
CYP2C19 P33261 2/20 0.38
MEN1 O00255 2/20 0.38
CYP1A2 P05177 1/20 0.38
TP53 P04637 1/20 0.37
KDM4E B2RXH2 1/20 0.37
MAPT P10636 1/20 0.37
IDO1 P14902 1/20 0.36
TDO2 P48775 1/20 0.36
CNR1 P21554 2/20 0.36
CNR2 P34972 1/20 0.36

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
SCHEMBL9820655 0.84 BCL2L1 (0.44) LMNANPSR1BCL2L1KMT2AGAA
SCHEMBL25177483 0.81 LMNA (0.39) LMNANPSR1PLAUF2F10
SCHEMBL30295348 0.81 LMNA (0.39) LMNANPSR1PLAUF2F10
SCHEMBL13696934 0.81 NPC1 (0.43) LMNANPSR1BCL2L1KMT2AGAA
SCHEMBL9820687 0.81 HSD17B10 (0.42) LMNANPSR1KMT2ACYP2C19MEN1
SCHEMBL4631386 0.73 KDM4E (0.54) LMNANPSR1BCL2L1KMT2AGAA
SCHEMBL13696933 0.72 AKR1C2 (0.41) LMNANPSR1KMT2AMEN1CYP1A2
SCHEMBL11067093 0.72 ALDH1A1 (0.46) LMNANPSR1BCL2L1KMT2AGAA
SCHEMBL909607 0.72 PLAU (0.50) LMNAPLAUF2F10PLG
SCHEMBL5940900 0.72 AKR1C2 (0.64) PLAUF2F10PLGPLAT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5017724-A Antihypoxic, CNS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1991-05-21 US disclosed
EP-0267024-B1 HYDROFLUORENE DERIVATIVES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1991-05-02 EP disclosed
EP-0267024-A2 Hydrofluorene derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1988-05-11 EP disclosed