SCHEMBL3857095

SCHEMBL3857095

Cn1c2c(c3cc(-c4ccc(O)cc4)ccc31)CCCC2

nearest known ligand 0.76

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.76
PTGS1 P23219 1/20 0.76
PTGS2 P35354 1/20 0.76
PTGDR2 Q9Y5Y4 2/20 0.39
BAZ2B Q9UIF8 1/20 0.38
HSD17B10 Q99714 2/20 0.37
HTR2A P28223 1/20 0.37
HTR2C P28335 1/20 0.37
KDM4E B2RXH2 2/20 0.37
ALOX15 P16050 1/20 0.36
MAPK1 P28482 1/20 0.36
LIMK1 P53667 1/20 0.36
ESR1 P03372 1/20 0.36
ESR2 Q92731 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
SCHEMBL3857090 0.83 PTGS1 (0.56) ALOX5PTGS1PTGS2PTGDR2
SCHEMBL14595449 0.82 ALOX5 (0.58) ALOX5PTGS1PTGS2HSD17B10HTR2A
SCHEMBL15101429 0.76 ALOX5 (0.67) ALOX5PTGS1PTGS2HSD17B10HTR2A
SCHEMBL3853703 0.76 ALOX5 (0.48) ALOX5PTGS1PTGS2
SCHEMBL3861613 0.75 ALOX5 (0.65) ALOX5PTGS1PTGS2BAZ2BHSD17B10
SCHEMBL13877233 0.75 ALOX5 (0.65) ALOX5PTGS1PTGS2HTR2AHTR2C
SCHEMBL1873708 0.75 PTGS1 (0.65) ALOX5PTGS1PTGS2BAZ2BHSD17B10
SCHEMBL3853296 0.75 CA1 (0.59) PTGS1PTGS2PTGDR2
SCHEMBL17895804 0.75 PTGS1 (0.68) ALOX5PTGS1PTGS2PTGDR2BAZ2B
SCHEMBL13478780 0.74 PTGS1 (0.64) ALOX5PTGS1PTGS2BAZ2BHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7582773-B2 Substituted phenyl indoles WYETH (US) 2009-09-01 US disclosed
US-20050070592-A1 Substituted phenyl indoles WYETH (US) 2005-03-31 US 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-20050070592-A1 Substituted phenyl indoles TPH2, IDO2, AANAT ALOX5 1638/4885PTGS1 2152/4885PTGS2 1495/4885

“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.