SCHEMBL5335837

SCHEMBL5335837

O=C(O)CCSC1c2ccccc2C=Cc2ccc(OCc3ccc4cc(F)c(Cl)cc4n3)cc21

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CYSLTR1 Q9Y271 12/20 0.39
CYSLTR2 Q9NS75 11/20 0.39
FFAR1 O14842 1/20 0.38
AKR1B1 P15121 1/20 0.38
ALOX5AP P20292 2/20 0.38
TBXA2R P21731 1/20 0.36
GPBAR1 Q8TDU6 1/20 0.36

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
SCHEMBL6571774 0.92 ALOX5AP (0.35) CYSLTR1CYSLTR2ALOX5APTBXA2RGPBAR1
SCHEMBL4056757 0.92 CYSLTR2 (0.37) CYSLTR1CYSLTR2FFAR1AKR1B1ALOX5AP
SCHEMBL4053392 0.85 CYSLTR1 (0.39) CYSLTR1CYSLTR2FFAR1AKR1B1ALOX5AP
SCHEMBL5331476 0.84 TBXA2R (0.42) TBXA2R
SCHEMBL5333781 0.82 PDE10A (0.40) CYSLTR1CYSLTR2ALOX5APGPBAR1
SCHEMBL4052136 0.82 CYSLTR2 (0.36) CYSLTR1CYSLTR2FFAR1AKR1B1ALOX5AP
SCHEMBL4229150 0.81 LTB4R (0.36) CYSLTR1CYSLTR2ALOX5APTBXA2R
SCHEMBL4051700 0.80 CYSLTR2 (0.38) CYSLTR1CYSLTR2FFAR1AKR1B1ALOX5AP
SCHEMBL4688152 0.80 CYSLTR2 (0.36) CYSLTR1CYSLTR2FFAR1AKR1B1ALOX5AP
SCHEMBL5337869 0.80 CYSLTR1 (0.42) CYSLTR1CYSLTR2TBXA2R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040180884-A1 Dibenzocycloheptene compound UBE INDUSTRIES, LTD. (JP) 2004-09-16 US claimed
EP-1408033-A1 DIBENZOCYCLOHEPTENE COMPOUND Ube Industries, Ltd. (JP) 2004-04-14 EP claimed
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 CYSLTR1 6/4885CYSLTR2 5/4885FFAR1 305/4885

“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.