SCHEMBL8320950

SCHEMBL8320950

COc1cc(C(=O)c2cc(OC)c(OC)c(OC)c2OC)c(O)c(OC)c1OC

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 1/20 0.51
KDM4E B2RXH2 2/20 0.47
POLB P06746 2/20 0.47
MAPT P10636 2/20 0.46
TDP1 Q9NUW8 1/20 0.46
HTT P42858 1/20 0.46
PTPN1 P18031 1/20 0.45
USP2 O75604 1/20 0.44
HSD17B10 Q99714 1/20 0.44
PKM P14618 1/20 0.44
CYP3A4 P08684 1/20 0.44
LMNA P02545 1/20 0.43
TPMT P51580 1/20 0.42
TUBB4A P04350 2/20 0.41
TUBB P07437 2/20 0.41
TUBA3C P0DPH7 2/20 0.41
TUBA1B P68363 2/20 0.41
TUBA4A P68366 2/20 0.41
TUBB4B P68371 2/20 0.41
TUBB3 Q13509 2/20 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
SCHEMBL7367549 0.82 MAPT (0.50) MCL1KDM4EPOLBMAPTTDP1
SCHEMBL7228025 0.81 MAPT (0.62) MCL1KDM4EPOLBMAPTTDP1
SCHEMBL11742991 0.80 MAPT (0.60) MCL1KDM4EMAPTTDP1HTT
SCHEMBL9573894 0.80 KDM4E (0.53) MCL1KDM4EPOLBMAPTTDP1
Water SCHEMBL9576667 0.80 MAPT (0.61) MCL1KDM4EPOLBMAPTTDP1
SCHEMBL9576652 0.80 KDM4E (0.67) MCL1KDM4EPOLBMAPTTDP1
SCHEMBL9573942 0.79 MCL1 (0.51) MCL1KDM4EPOLBMAPTTDP1
SCHEMBL1438926 0.77 PKM (0.62) KDM4EPOLBMAPTTDP1HTT
SCHEMBL2137968 0.76 MAPT (0.58) KDM4EMAPTHTTHSD17B10CYP3A4
SCHEMBL15233646 0.76 KDM4E (0.51) MCL1KDM4EPOLBMAPTHTT

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-5977077-A PARASITICIDES; ANTIPROTOZOA AGENT INTERLAB CORPORATION (US) 1999-11-02 US disclosed