SCHEMBL4387022

SCHEMBL4387022

CCc1c(O)cc(O)c(-c2ccccc2)c1CCCOCC(N)=O

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 1/20 0.44
DPP4 P27487 5/20 0.40
POLB P06746 1/20 0.36
RECQL P46063 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
LTB4R Q15722 3/20 0.35
LTB4R2 Q9NPC1 3/20 0.35
ESR1 P03372 1/20 0.34
ESR2 Q92731 1/20 0.34
GCGR P47871 1/20 0.34
KDM4E B2RXH2 1/20 0.34
GAA P10253 1/20 0.33
FABP3 P05413 1/20 0.33
FABP4 P15090 1/20 0.33
FABP5 Q01469 1/20 0.33
ADORA3 P0DMS8 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC2 Q92769 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
SCHEMBL4378125 0.93 CNR2 (0.43) CNR2DPP4POLBRECQLSMN1; SMN2
SCHEMBL4240306 0.86 CNR2 (0.40) CNR2POLBRECQLSMN1; SMN2LTB4R
SCHEMBL4395152 0.86 CNR2 (0.40) CNR2POLBRECQLSMN1; SMN2LTB4R
SCHEMBL4391973 0.83 CNR2 (0.39) CNR2POLBRECQLSMN1; SMN2LTB4R
SCHEMBL4396284 0.83 CNR2 (0.40) CNR2RECQLSMN1; SMN2KDM4EGAA
SCHEMBL4386191 0.82 POLB (0.42) CNR2DPP4POLBRECQLSMN1; SMN2
SCHEMBL4377955 0.82 CNR2 (0.38) CNR2POLBRECQLSMN1; SMN2ESR1
SCHEMBL4387546 0.82 HPGD (0.42) RECQLKDM4E
SCHEMBL4381573 0.80 CNR2 (0.37) CNR2POLBRECQLSMN1; SMN2LTB4R
SCHEMBL4385437 0.79 CNR2 (0.39) CNR2POLBRECQLSMN1; SMN2LTB4R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7538241-B2 Hsp90 family protein inhibitors KYOWA HAKKO KOGYO CO., LTD. (JP) 2009-05-26 US disclosed
US-20070155813-A1 Hsp90 family protein inhibitors KYOWA HAKKO KOGYO CO., LTD. (JP) 2007-07-05 US disclosed
EP-1704856-A1 HSP90 FAMILY PROTEIN INHIBITOR KYOWA HAKKO KOGYO CO., LTD. (JP) 2006-09-27 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 (1 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-20070155813-A1 Hsp90 family protein inhibitors HSP90AB1, HEATR1, HSP90AB2P CNR2 1898/4885DPP4 4407/4885POLB 3913/4885

“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.