SCHEMBL4019779

SCHEMBL4019779

COc1ccc([C@@H](C)CNCCc2ccccc2)cc1

nearest known ligand 0.78

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.78
KMT2A Q03164 5/20 0.78
SMN1; SMN2 Q16637 2/20 0.59
KDM4E B2RXH2 1/20 0.59
GAA P10253 1/20 0.59
TDP1 Q9NUW8 1/20 0.59
ATM Q13315 1/20 0.55
BCHE P06276 3/20 0.53
CCR3 P51677 2/20 0.53
ALDH1A1 P00352 2/20 0.52
POLB P06746 2/20 0.52
ADRB2 P07550 2/20 0.51
HTT P42858 1/20 0.50
SIGMAR1 Q99720 1/20 0.50
ANPEP P15144 1/20 0.49
ERAP2 Q6P179 1/20 0.49

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
Hydrochloric Acid SCHEMBL4015079 0.99 MEN1 (0.76) MEN1KMT2ASMN1; SMN2KDM4EGAA
SCHEMBL9372958 0.92 KMT2A (0.67) MEN1KMT2ASMN1; SMN2KDM4EGAA
SCHEMBL6226287 0.86 MEN1 (0.65) MEN1KMT2AGAABCHECCR3
SCHEMBL8101725 0.86 MEN1 (0.63) MEN1KMT2ASMN1; SMN2KDM4EGAA
SCHEMBL2168241 0.85 BCHE (0.68) MEN1KMT2ASMN1; SMN2KDM4ETDP1
SCHEMBL5970737 0.85 BCHE (0.68) MEN1KMT2ASMN1; SMN2KDM4ETDP1
SCHEMBL4614753 0.81 MEN1 (0.71) MEN1KMT2ASMN1; SMN2KDM4EGAA
SCHEMBL8100061 0.80 MEN1 (0.53) MEN1KMT2ABCHESIGMAR1
SCHEMBL29057187 0.79 PKM (0.63) MEN1KMT2ASMN1; SMN2GAAATM
SCHEMBL10717538 0.78 KDM4E (0.90) MEN1KMT2ASMN1; SMN2KDM4EGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1828110-B8 PROCESS FOR THE PREPARATION OF TAMSULOSIN AND INTERMEDIATES THEREOF HOVIONE INT LTD (CH) 2009-07-01 EP claimed
EP-1828110-A1 PROCESS FOR THE PREPARATION OF TAMSULOSIN AND INTERMEDIATES THEREOF Hovione Inter Ltd. (CH) 2007-09-05 EP claimed
WO-2006061549-A1 PROCESS FOR THE PREPARATION OF TAMSULOSIN AND INTERMEDIATES THEREOF HOVIONE INTER LTD. (CH) 2006-06-15 WO claimed
EP-1828110-B8 PROCESS FOR THE PREPARATION OF TAMSULOSIN AND INTERMEDIATES THEREOF HOVIONE INT LTD (CH) 2009-07-01 EP disclosed
EP-1828110-A1 PROCESS FOR THE PREPARATION OF TAMSULOSIN AND INTERMEDIATES THEREOF Hovione Inter Ltd. (CH) 2007-09-05 EP disclosed
WO-2006061549-A1 PROCESS FOR THE PREPARATION OF TAMSULOSIN AND INTERMEDIATES THEREOF HOVIONE INTER LTD. (CH) 2006-06-15 WO disclosed