SCHEMBL4386207

SCHEMBL4386207

CCc1c(CC(=O)N(C)CCOC)cc(OCOC)cc1OCOC

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LTB4R Q15722 8/20 0.34
LTB4R2 Q9NPC1 8/20 0.34
ALDH1A1 P00352 2/20 0.32
SIGMAR1 Q99720 1/20 0.32
KDM4E B2RXH2 1/20 0.32
MAPT P10636 2/20 0.31
CYP2D6 P10635 2/20 0.31
LMNA P02545 1/20 0.31
CYP3A4 P08684 1/20 0.30
CYP2C9 P11712 1/20 0.30
TSHR P16473 1/20 0.30
CYP2C19 P33261 1/20 0.30

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
SCHEMBL4387141 0.79 LMNA (0.33) MAPTLMNA
SCHEMBL2858252 0.79 BACE1 (0.35) ALDH1A1KDM4EMAPTCYP2D6LMNA
SCHEMBL2863612 0.77 TNFRSF1A (0.32)
SCHEMBL4380682 0.73 SIGMAR1 (0.40) ALDH1A1SIGMAR1KDM4ECYP2D6TSHR
SCHEMBL4381965 0.72 F2 (0.31) KDM4E
SCHEMBL4384082 0.72 L3MBTL1 (0.34) ALDH1A1KDM4EMAPTLMNA
SCHEMBL2866362 0.72 DHODH (0.32) ALDH1A1MAPTCYP2D6CYP3A4CYP2C9
SCHEMBL3624731 0.70 TLR9 (0.32)
SCHEMBL4382475 0.66 EGFR (0.37) LTB4RLTB4R2ALDH1A1SIGMAR1MAPT
SCHEMBL2864972 0.66 ALDH1A1 (0.30) ALDH1A1

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 LTB4R 3831/4885LTB4R2 4504/4885ALDH1A1 3520/4885

“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.