SCHEMBL6624311

SCHEMBL6624311

CC(C)(C)OC(=O)C(CO)C(=O)NN

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.34
CA2 P00918 2/20 0.34
CTSS P25774 6/20 0.33
CTSK P43235 6/20 0.33
TDP1 Q9NUW8 2/20 0.33
HIF1A Q16665 1/20 0.32
CTSL P07711 1/20 0.32
CTSB P07858 1/20 0.32
CA7 P43166 1/20 0.32
DGAT1 O75907 1/20 0.31
NOS1 P29475 2/20 0.31
NOS3 P29474 1/20 0.31
NOS2 P35228 1/20 0.31
MEN1 O00255 1/20 0.31
GAA P10253 1/20 0.31
KMT2A Q03164 1/20 0.31
APLNR P35414 1/20 0.30
POLB P06746 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
PRKCA P17252 1/20 0.30

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
SCHEMBL4897617 0.82 KMT2A (0.33) CA1CA2CTSSCTSKHIF1A
SCHEMBL28360012 0.82 PRKCA (0.36) CA1CA2CTSKTDP1CA7
SCHEMBL30811424 0.80 FOLH1 (0.41) CA1CA2CTSSCTSKNOS1
SCHEMBL3738506 0.79 DGAT1 (0.39) CA1CA2CTSKTDP1CA7
SCHEMBL5943155 0.78 CPB2 (0.39) CA1CA2MEN1GAAKMT2A
SCHEMBL3745034 0.78 KMT2A (0.39) CA1CA2CTSSCTSKTDP1
SCHEMBL3745027 0.78 KMT2A (0.39) CA1CA2CTSSCTSKTDP1
Ammonia Solution, Strong SCHEMBL27983360 0.77 CA12 (0.38) CA1CA2CTSKTDP1CA7
SCHEMBL38654786 0.73 NOS1 (0.33) CA1CA2NOS1NOS3NOS2
SCHEMBL19560807 0.71 CTSK (0.48) CA1CA2CTSSCTSKCTSL

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-1264836-B1 Processes for the preparation of indolopyrrolocarbazole derivatives BANYU PHARMA CO LTD (JP) 2004-12-01 EP disclosed
EP-0760375-B1 ANTITUMOR INDOLOPYPROLOCARBAZOLE DERIVATIVE BANYU PHARMA CO LTD (JP) 2003-11-26 EP disclosed
EP-1264836-A1 Processes for the preparation of indolopyrrolocarbazole derivatives BANYU PHARMACEUTICAL CO., LTD. (JP) 2002-12-11 EP disclosed
US-5922860-A Antitumor indolopyrrolocarbazole derivatives BANYU PHARMACEUTICAL CO., LTD. (JP) 1999-07-13 US disclosed
US-5804564-A Antitumor indolopyrrolocarbazole derivatives BANYU PHARMACEUTICAL CO., LTD. (JP) 1998-09-08 US disclosed
EP-0760375-A1 ANTITUMOR INDOLOPYPROLOCARBAZOLE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 1997-03-05 EP disclosed