SCHEMBL4388215

SCHEMBL4388215

CCc1c(OCc2ccccc2)cc(OCc2ccccc2)c(Br)c1Cc1nn(CCOC)c(=O)o1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 2/20 0.38
MGLL Q99685 2/20 0.38
MAOB P27338 2/20 0.37
MAPK14 Q16539 3/20 0.37
CYP2C19 P33261 2/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
GAA P10253 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
HPGD P15428 1/20 0.35
KMT2A Q03164 1/20 0.35
BCHE P06276 1/20 0.34
LIPC P11150 1/20 0.34
ACHE P22303 1/20 0.34
LIPE Q05469 1/20 0.34
TRPA1 O75762 1/20 0.34
MTNR1A P48039 1/20 0.34
MTNR1B P49286 1/20 0.34
NLRP3 Q96P20 2/20 0.34

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
SCHEMBL4396313 0.90 MAOB (0.38) FAAHMGLLMAOBMAPK14BCHE
SCHEMBL4380795 0.88 FAAH (0.38) FAAHMGLLMAOBMAPK14CYP2C19
SCHEMBL4386011 0.84 KDM4C (0.34) FAAHMGLLMAOBMAPK14MEN1
SCHEMBL4384187 0.84 FAAH (0.36) FAAHMGLLMAOBCYP2C19MEN1
SCHEMBL4388883 0.78 MAOB (0.37) FAAHMGLLMAOBMAPK14BCHE
SCHEMBL4385063 0.77 MAPK14 (0.39) MAOBMAPK14
SCHEMBL4380922 0.75 FAAH (0.41) FAAHMGLLKMT2ABCHELIPC
SCHEMBL4387544 0.74 KDM4C (0.33) MAOBTRPA1
SCHEMBL4394356 0.72 NLRP3 (0.36) FAAHMGLLCYP2C19MEN1ALDH1A1
SCHEMBL7297318 0.69 MAOB (0.71) FAAHMGLLMAOB

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 FAAH 3872/4885MGLL 4472/4885MAOB 3920/4885

“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.