SCHEMBL9736347

SCHEMBL9736347

O=C1CCn2c1cc1cc(Oc3ccccc3)ccc12

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GALR3 O60755 1/20 0.41
GAA P10253 1/20 0.41
PIM1 P11309 2/20 0.40
ALDH1A1 P00352 3/20 0.39
RPS6KA2 Q15349 1/20 0.38
KDM4E B2RXH2 2/20 0.38
MEN1 O00255 1/20 0.38
POLB P06746 1/20 0.38
HPGD P15428 1/20 0.38
KMT2A Q03164 1/20 0.38
HSD17B10 Q99714 1/20 0.38
GSTP1 P09211 1/20 0.37
HRH3 Q9Y5N1 6/20 0.37
GFER P55789 2/20 0.37
MAOA P21397 1/20 0.37
MAOB P27338 1/20 0.37
CYP2D6 P10635 2/20 0.37
ACHE P22303 1/20 0.37

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
SCHEMBL9264795 0.81 KDM4E (0.56) GAAALDH1A1KDM4EMEN1POLB
SCHEMBL9844694 0.78 HRH3 (0.47) ALDH1A1KDM4EMEN1POLBHPGD
SCHEMBL2019621 0.75 MAOB (0.51) GAAALDH1A1MEN1HPGDKMT2A
SCHEMBL9387355 0.68 HTR2A (0.41) ALDH1A1RPS6KA2KDM4EKMT2AHSD17B10
SCHEMBL9789564 0.67 LTA4H (0.67) GAAALDH1A1MEN1KMT2AGSTP1
SCHEMBL11719516 0.64 MEN1 (0.64) GALR3GAAALDH1A1KDM4EMEN1
SCHEMBL9515088 0.63 LTA4H (0.60) GAAALDH1A1MEN1KMT2AGSTP1
SCHEMBL4402154 0.63 LTA4H (0.60) GAAKDM4EMEN1KMT2AGSTP1
SCHEMBL29860094 0.63 LTA4H (0.60) GAAKDM4EMEN1KMT2AGSTP1
SCHEMBL1745079 0.62 GRM5 (0.53) HSD17B10GSTP1HRH3MAOAMAOB

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-1992021678-A1 LIPOXYGENASE INHIBITING PYRROLO [1,2a]INDOLE COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 1992-12-10 WO disclosed