SCHEMBL2866299

SCHEMBL2866299

C=CCOc1cc(CC(=O)OC)c(C(C)=O)c(OCC=C)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 1/20 0.39
KDM4E B2RXH2 3/20 0.37
POLB P06746 2/20 0.37
MAPT P10636 2/20 0.37
ABL1 P00519 1/20 0.37
RECQL P46063 1/20 0.37
RIN1 Q13671 1/20 0.37
CTDSP1 Q9GZU7 1/20 0.37
MTNR1A P48039 2/20 0.35
ALDH1A1 P00352 2/20 0.35
PTPN1 P18031 3/20 0.35
LIG1 P18858 1/20 0.35
SMN1; SMN2 Q16637 4/20 0.34
LMNA P02545 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
GAA P10253 1/20 0.34
TSHR P16473 1/20 0.34
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
MEN1 O00255 1/20 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
SCHEMBL2861681 0.83 FLT3 (0.47) FLT3KDM4EPOLBMAPTALDH1A1
SCHEMBL2862910 0.82 FLT3 (0.41) FLT3KDM4EPOLBMAPTMTNR1A
SCHEMBL1939998 0.81 KDM4E (0.48) FLT3KDM4EALDH1A1PTPN1SMN1; SMN2
SCHEMBL12375337 0.78 CYP3A4 (0.51) FLT3KDM4EPOLBMAPTABL1
SCHEMBL2857252 0.75 HSP90AB1 (0.50) FLT3KDM4EPOLBMAPTMTNR1A
SCHEMBL2863493 0.74 MAPT (0.45) FLT3KDM4EPOLBMAPTABL1
SCHEMBL19462926 0.73 CYP3A4 (0.43) FLT3KDM4EPOLBMAPTALDH1A1
SCHEMBL10963506 0.73 CYP3A4 (0.65) FLT3KDM4EPOLBMAPTABL1
SCHEMBL29928265 0.73 CYP3A4 (0.49) FLT3KDM4EPOLBMAPTABL1
SCHEMBL31463464 0.69 SMN1; SMN2 (0.38) FLT3KDM4EMAPTMTNR1AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1642880-B1 HSP90 FAMILY PROTEIN INHIBITORS KYOWA HAKKO KIRIN CO LTD (JP) 2013-09-04 EP disclosed
US-7767693-B2 Hsp90 family protein inhibitors KYOWA HAKKO KIRIN CO., LTD. (JP) 2010-08-03 US disclosed
US-20090247522-A1 Hsp90 FAMILY PROTEIN INHIBITORS KYOWA HAKKO KOGYO CO., LTD. (JP) 2009-10-01 US disclosed
US-7538224-B2 Hsp90 family protein inhibitors KYOWA HAKKO KOGYO CO., LTD. (JP) 2009-05-26 US disclosed
US-20070032532-A1 Hsp90 family protein inhibitors KYOWA HAKKO KOGYO CO., LTD. (JP) 2007-02-08 US disclosed
EP-1642880-A1 HSP90 FAMILY PROTEIN INHIBITORS KYOWA HAKKO KOGYO CO., LTD. (JP) 2006-04-05 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070032532-A1 Hsp90 family protein inhibitors HSP90AB1, HSP90B1, HSP90AB2P FLT3 1075/4885KDM4E 2968/4885POLB 4195/4885
US-20090247522-A1 Hsp90 FAMILY PROTEIN INHIBITORS HSP90AB1, HSP90B1, HSP90AB2P FLT3 1075/4885KDM4E 2968/4885POLB 4195/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.