SCHEMBL7803356

SCHEMBL7803356

CCCCN(CCCC)c1ccc2c(c1)O/C(=C1/OC(=O)c3ccc(N(CCCC)CCCC)cc31)C2=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 4/20 0.39
ALDH1A1 P00352 5/20 0.36
KDM4E B2RXH2 1/20 0.36
POLB P06746 1/20 0.36
GAA P10253 1/20 0.36
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
MAPT P10636 2/20 0.36
HPGD P15428 3/20 0.36
CASP1 P29466 2/20 0.36
CASP7 P55210 2/20 0.36
USP2 O75604 1/20 0.36
TSHR P16473 1/20 0.36
RECQL P46063 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
MAOB P27338 1/20 0.34
IGLV6-57 P01721 2/20 0.33
MAPK1 P28482 2/20 0.33
HSD17B10 Q99714 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33

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
SCHEMBL7801109 1.00 AR (0.39) ARALDH1A1KDM4EPOLBGAA
SCHEMBL7799196 1.00 AR (0.39) ARALDH1A1KDM4EPOLBGAA
SCHEMBL7793602 0.96 ALDH1A1 (0.37) ARALDH1A1KDM4EPOLBGAA
SCHEMBL7803351 0.96 ALDH1A1 (0.37) ARALDH1A1KDM4EPOLBGAA
SCHEMBL7799217 0.96 ALDH1A1 (0.37) ARALDH1A1KDM4EPOLBGAA
SCHEMBL7799398 0.95 ALDH1A1 (0.37) ARALDH1A1KDM4EPOLBGAA
SCHEMBL7793554 0.95 ALDH1A1 (0.37) ARALDH1A1KDM4EPOLBGAA
SCHEMBL7799226 0.95 ALDH1A1 (0.37) ARALDH1A1KDM4EPOLBGAA
SCHEMBL7793665 0.95 ALDH1A1 (0.37) ARALDH1A1KDM4EPOLBGAA
SCHEMBL7801136 0.95 ALDH1A1 (0.37) ARALDH1A1KDM4EPOLBGAA

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