SCHEMBL7801117

SCHEMBL7801117

CCN(CC)c1ccc2c(c1)OC(=C1Oc3cc(N(CC)CC)ccc3C1=O)C2=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.49
ALDH1A1 P00352 9/20 0.49
L3MBTL1 Q9Y468 5/20 0.49
MEN1 O00255 4/20 0.49
MAPT P10636 4/20 0.49
KMT2A Q03164 4/20 0.49
HSD17B10 Q99714 3/20 0.49
HPGD P15428 3/20 0.49
MAPK1 P28482 2/20 0.49
GLA P06280 4/20 0.48
CASP1 P29466 2/20 0.48
CASP7 P55210 2/20 0.48
CYP3A4 P08684 2/20 0.48
IGLV6-57 P01721 2/20 0.48
ATM Q13315 2/20 0.48
HIF1A Q16665 1/20 0.48
KDM4E B2RXH2 5/20 0.46
HTT P42858 2/20 0.46
TP53 P04637 1/20 0.46
ALOX15 P16050 1/20 0.46

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
SCHEMBL7802423 1.00 MAOB (0.49) MAOBALDH1A1L3MBTL1MEN1MAPT
SCHEMBL7801115 1.00 MAOB (0.49) MAOBALDH1A1L3MBTL1MEN1MAPT
SCHEMBL7801121 0.91 ALDH1A1 (0.46) MAOBALDH1A1L3MBTL1MEN1MAPT
SCHEMBL7803302 0.91 ALDH1A1 (0.46) MAOBALDH1A1L3MBTL1MEN1MAPT
SCHEMBL7802429 0.91 ALDH1A1 (0.46) MAOBALDH1A1L3MBTL1MEN1MAPT
SCHEMBL7799208 0.87 IGLV6-57 (0.45) MAOBALDH1A1L3MBTL1MEN1MAPT
SCHEMBL7799406 0.87 IGLV6-57 (0.45) MAOBALDH1A1L3MBTL1MEN1MAPT
SCHEMBL7799213 0.87 IGLV6-57 (0.45) MAOBALDH1A1L3MBTL1MEN1MAPT
SCHEMBL7801103 0.84 AR (0.40) MAOBALDH1A1L3MBTL1MEN1MAPT
SCHEMBL7799193 0.84 AR (0.40) MAOBALDH1A1L3MBTL1MEN1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0900255-B1 DONOR-SUBSTITUTED OXINDIGO DERIVATIVES AND THEIR USE AS COLOURANTS CIBA SC HOLDING AG (CH) 2001-12-19 EP disclosed
US-6156914-A Donor-substituted oxindigo derivatives and their use as colorants CIBA SPECIALTY CHEMICALS CORPORATION (US) 2000-12-05 US disclosed
EP-0900255-A1 DONOR-SUBSTITUTED OXINDIGO DERIVATIVES AND THEIR USE AS COLOURANTS Ciba SC Holding AG (CH) 1999-03-10 EP disclosed
WO-1997041176-A1 DONOR-SUBSTITUTED OXINDIGO DERIVATIVES AND THEIR USE AS COLOURANTS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 1997-11-06 WO disclosed