SCHEMBL5336504

SCHEMBL5336504

O=c1c2ccccc2ccc2ccc(C=Cc3ccc4cc(F)c(F)cc4n3)cc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLA P06280 2/20 0.42
RAB9A P51151 7/20 0.42
NPC1 O15118 6/20 0.42
KDM4E B2RXH2 5/20 0.42
LMNA P02545 3/20 0.42
PKM P14618 2/20 0.42
MAPT P10636 4/20 0.42
L3MBTL1 Q9Y468 3/20 0.42
CYSLTR1 Q9Y271 3/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
MAPK1 P28482 2/20 0.42
CYSLTR2 Q9NS75 2/20 0.42
RXFP1 Q9HBX9 1/20 0.42
SMN1; SMN2 Q16637 4/20 0.42
NFKB1 P19838 2/20 0.42
NFKB2 Q00653 2/20 0.42
RELA Q04206 2/20 0.42
ALDH1A1 P00352 2/20 0.42
TDP1 Q9NUW8 1/20 0.42

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
SCHEMBL5336499 1.00 GLA (0.42) GLARAB9ANPC1KDM4ELMNA
SCHEMBL5334885 0.90 GLA (0.39) GLARAB9ANPC1KDM4ELMNA
SCHEMBL5334880 0.90 GLA (0.39) GLARAB9ANPC1KDM4ELMNA
SCHEMBL4060335 0.87 MET (0.44) RAB9ANPC1KDM4EPKMMAPT
SCHEMBL4060332 0.87 MET (0.44) RAB9ANPC1KDM4EPKMMAPT
SCHEMBL5338891 0.82 CYSLTR1 (0.47) GLARAB9ANPC1KDM4ELMNA
SCHEMBL5338886 0.82 CYSLTR1 (0.47) GLARAB9ANPC1KDM4ELMNA
SCHEMBL5333926 0.80 CYSLTR1 (0.39) RAB9ANPC1KDM4ELMNAMAPT
SCHEMBL5337401 0.80 CYSLTR1 (0.39) RAB9ANPC1KDM4ELMNAPKM
SCHEMBL5337396 0.80 CYSLTR1 (0.39) RAB9ANPC1KDM4ELMNAPKM

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-7309718-B2 Dibenzocycloheptene compound UBE INDUSTRIES, LTD. (JP) 2007-12-18 US disclosed
US-20040180884-A1 Dibenzocycloheptene compound UBE INDUSTRIES, LTD. (JP) 2004-09-16 US disclosed
EP-1408033-A1 DIBENZOCYCLOHEPTENE COMPOUND Ube Industries, Ltd. (JP) 2004-04-14 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-20040180884-A1 Dibenzocycloheptene compound LTB4R2, LTA4H, LTC4S GLA 4620/4885RAB9A 4143/4885NPC1 1268/4885

“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.