SCHEMBL2856148

SCHEMBL2856148

C=CCOc1cc(OCC=C)c(C(=O)c2ccc(OC(F)(F)F)cc2)c(CC(=O)OC)c1CC

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
KDM4E B2RXH2 1/20 0.38
VNN1 O95497 1/20 0.38
MRGPRX4 Q96LA9 1/20 0.36
GCGR P47871 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
NPC1 O15118 3/20 0.35
RAB9A P51151 3/20 0.35
POLB P06746 2/20 0.35
HDAC3 O15379 1/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC2 Q92769 1/20 0.35
MAPT P10636 1/20 0.35
EPHX2 P34913 1/20 0.35
NR1H4 Q96RI1 1/20 0.35
AKR1C3 P42330 1/20 0.35
PPARG P37231 1/20 0.35
PPARD Q03181 1/20 0.35

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
SCHEMBL2858286 0.89 KDM4E (0.44) SMN1; SMN2MEN1KMT2AKDM4ENPC1
SCHEMBL2858300 0.88 MAPT (0.47) SMN1; SMN2KMT2AKDM4EL3MBTL1NPC1
SCHEMBL2866517 0.87 KDM4E (0.41) SMN1; SMN2KDM4EL3MBTL1NPC1RAB9A
SCHEMBL2856163 0.86 KDM4E (0.38) SMN1; SMN2MEN1KMT2AKDM4EL3MBTL1
SCHEMBL2861144 0.86 KDM4E (0.42) SMN1; SMN2KDM4ENPC1RAB9APOLB
SCHEMBL2871399 0.85 KDM4E (0.39) SMN1; SMN2KMT2AKDM4ENPC1RAB9A
SCHEMBL2859038 0.85 KDM4E (0.40) SMN1; SMN2MEN1KMT2AKDM4EL3MBTL1
SCHEMBL2859968 0.82 KDM4E (0.54) MEN1KMT2AKDM4EHDAC3HDAC1
SCHEMBL2857450 0.82 KDM4E (0.46) SMN1; SMN2MEN1KMT2AKDM4ERAB9A
SCHEMBL2861686 0.81 KDM4E (0.47) MEN1KMT2AKDM4ERAB9APOLB

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 SMN1; SMN2 4682/4885MEN1 4773/4885KMT2A 3681/4885
US-20090247522-A1 Hsp90 FAMILY PROTEIN INHIBITORS HSP90AB1, HSP90B1, HSP90AB2P SMN1; SMN2 4682/4885MEN1 4773/4885KMT2A 3681/4885

“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.