SCHEMBL8060265

SCHEMBL8060265

CCCN(CCC)c1ccc2c(c1)OC(=C1OC(=O)c3ccc(N(CCC)CCC)cc31)C2=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IGLV6-57 P01721 2/20 0.40
AR P10275 4/20 0.36
MAOB P27338 3/20 0.35
ALDH1A1 P00352 4/20 0.35
HPGD P15428 3/20 0.35
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
MAPK1 P28482 3/20 0.35
HSD17B10 Q99714 3/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
MAPT P10636 2/20 0.35
S1PR1 P21453 1/20 0.33
CASP1 P29466 3/20 0.32
CASP7 P55210 3/20 0.32
RECQL P46063 2/20 0.32
USP2 O75604 1/20 0.32
TSHR P16473 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
GLA P06280 1/20 0.32
CYP3A4 P08684 1/20 0.32

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
SCHEMBL7799407 1.00 IGLV6-57 (0.40) IGLV6-57ARMAOBALDH1A1HPGD
SCHEMBL7799210 1.00 IGLV6-57 (0.40) IGLV6-57ARMAOBALDH1A1HPGD
SCHEMBL7803356 0.92 AR (0.39) IGLV6-57ARMAOBALDH1A1HPGD
SCHEMBL7799196 0.92 AR (0.39) IGLV6-57ARMAOBALDH1A1HPGD
SCHEMBL7801109 0.92 AR (0.39) IGLV6-57ARMAOBALDH1A1HPGD
SCHEMBL7799406 0.92 IGLV6-57 (0.45) IGLV6-57ARMAOBALDH1A1HPGD
SCHEMBL7799213 0.92 IGLV6-57 (0.45) IGLV6-57ARMAOBALDH1A1HPGD
SCHEMBL7799208 0.92 IGLV6-57 (0.45) IGLV6-57ARMAOBALDH1A1HPGD
SCHEMBL7803351 0.91 ALDH1A1 (0.37) IGLV6-57ARMAOBALDH1A1HPGD
SCHEMBL7793602 0.91 ALDH1A1 (0.37) IGLV6-57ARMAOBALDH1A1HPGD

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-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