SCHEMBL5335091

SCHEMBL5335091

OC1c2cc(/C=C/c3ccc4cc(F)c(Cl)cc4n3)ccc2C=Cc2c(F)cccc21

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 8/20 0.36
CYSLTR1 Q9Y271 8/20 0.36
NPC1 O15118 5/20 0.35
RAB9A P51151 5/20 0.35
KDM4E B2RXH2 4/20 0.35
SMN1; SMN2 Q16637 4/20 0.35
ALDH1A1 P00352 2/20 0.35
NFKB1 P19838 2/20 0.35
NFKB2 Q00653 2/20 0.35
RELA Q04206 2/20 0.35
HPGD P15428 1/20 0.35
LMNA P02545 3/20 0.33
MAPT P10636 3/20 0.33
KMT2A Q03164 2/20 0.33
HTT P42858 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 2/20 0.31
PKM P14618 1/20 0.31
MEN1 O00255 1/20 0.31
PTPN1 P18031 2/20 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
SCHEMBL5335095 1.00 CYSLTR2 (0.36) CYSLTR2CYSLTR1NPC1RAB9AKDM4E
SCHEMBL5337057 0.91 CYSLTR2 (0.36) CYSLTR2CYSLTR1NPC1RAB9AKDM4E
SCHEMBL5337055 0.91 CYSLTR2 (0.36) CYSLTR2CYSLTR1NPC1RAB9AKDM4E
SCHEMBL5369960 0.91 CYSLTR2 (0.33) CYSLTR2CYSLTR1NPC1RAB9AKDM4E
SCHEMBL5369956 0.91 CYSLTR2 (0.33) CYSLTR2CYSLTR1NPC1RAB9AKDM4E
SCHEMBL5338657 0.87 KDM4E (0.36) CYSLTR2CYSLTR1NPC1RAB9AKDM4E
SCHEMBL5338662 0.87 KDM4E (0.36) CYSLTR2CYSLTR1NPC1RAB9AKDM4E
SCHEMBL5331886 0.86 CYSLTR2 (0.36) CYSLTR2CYSLTR1NPC1RAB9AKDM4E
SCHEMBL5331882 0.86 CYSLTR2 (0.36) CYSLTR2CYSLTR1NPC1RAB9AKDM4E
SCHEMBL5335917 0.83 CYSLTR2 (0.38) CYSLTR2CYSLTR1MAPT

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 CYSLTR2 5/4885CYSLTR1 6/4885NPC1 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.