SCHEMBL9975748

SCHEMBL9975748

COC(=O)c1ccc([Co](=O)c2ccc(C(=O)Oc3ccc(C=O)cc3)cc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.64
KMT2A Q03164 8/20 0.48
MAPT P10636 7/20 0.48
ACR P10323 3/20 0.48
HGFAC Q04756 1/20 0.48
GFER P55789 1/20 0.48
KDM4E B2RXH2 3/20 0.47
PRSS1 P07477 1/20 0.47
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
NPC1 O15118 1/20 0.45
LMNA P02545 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
POLB P06746 1/20 0.44
MEN1 O00255 1/20 0.43
CYP2A6 P11509 1/20 0.41
PARP10 Q53GL7 1/20 0.41
PARP3 Q9Y6F1 1/20 0.41

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
SCHEMBL11943001 0.90 ACR (0.56) ALDH1A1KMT2AMAPTACRHGFAC
SCHEMBL15373867 0.90 ALDH1A1 (0.79) ALDH1A1KMT2AMAPTACRHGFAC
SCHEMBL9975749 0.89 KMT2A (0.51) ALDH1A1KMT2AMAPTACRGFER
SCHEMBL4243129 0.82 KMT2A (0.63) ALDH1A1KMT2AMAPTHGFACGFER
SCHEMBL9400232 0.82 KMT2A (0.63) ALDH1A1KMT2AMAPTHGFACGFER
SCHEMBL13476352 0.81 KMT2A (0.69) ALDH1A1KMT2AMAPTACRGFER
SCHEMBL15500749 0.81 KMT2A (0.69) ALDH1A1KMT2AMAPTACRGFER
SCHEMBL14513468 0.81 KMT2A (0.69) ALDH1A1KMT2AMAPTACRGFER
SCHEMBL79533 0.80 ALDH1A1 (1.00) ALDH1A1KMT2AMAPTCA1CA2
SCHEMBL28033399 0.80 ALDH1A1 (1.00) ALDH1A1KMT2AMAPTCA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120156399-A1 CELLULOSE ESTER FILM, POLARIZING PLATE, LIQUID CRYSTAL DISPLAY AND PROCESS FOR PRODUCING CELLULOSE ESTER FILM FUJIFILM CORPORATION (JP) 2012-06-21 US disclosed