SCHEMBL22877403

SCHEMBL22877403

COC(=O)C(C(=O)OC)C1c2ccccc2OCC1Cc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LTB4R Q15722 16/20 0.55
LTB4R2 Q9NPC1 16/20 0.55
RIPK1 Q13546 3/20 0.43
PSMB5 P28074 1/20 0.41

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
SCHEMBL26429478 0.94 LTB4R (0.52) LTB4RLTB4R2RIPK1PSMB5
SCHEMBL26429681 0.89 LTB4R (0.54) LTB4RLTB4R2RIPK1PSMB5
SCHEMBL22877159 0.85 LTB4R (0.42) LTB4RLTB4R2PSMB5
SCHEMBL22877204 0.84 POLB (0.40) LTB4RLTB4R2PSMB5
SCHEMBL26429346 0.84 CYP2D6 (0.39) LTB4RLTB4R2PSMB5
SCHEMBL22877375 0.84 POLB (0.40) LTB4RLTB4R2PSMB5
SCHEMBL22877362 0.82 SLC6A2 (0.38) LTB4RLTB4R2PSMB5
SCHEMBL26429440 0.81 CYP2D6 (0.40) LTB4RLTB4R2PSMB5
SCHEMBL26704684 0.80 ALDH1A1 (0.39) LTB4RLTB4R2PSMB5
SCHEMBL26705039 0.79 POLB (0.39) LTB4RLTB4R2PSMB5

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-20230339879-A1 SUBSTITUTED CHROMANES, ANALOGS THEREOF, AND METHODS OF USE AND SYNTHESIS NORTHWESTERN UNIVERSITY 2023-10-26 US disclosed
US-11639340-B2 Substituted chromanes, analogs thereof, and methods of use and synthesis NORTHWESTERN UNIVERSITY (US) 2023-05-02 US disclosed
US-20210009547-A1 SUBSTITUTED CHROMANES, ANALOGS THEREOF, AND METHODS OF USE AND SYNTHESIS NORTHWESTERN UNIVERSITY (US) 2021-01-14 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 (3 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-20210009547-A1 SUBSTITUTED CHROMANES, ANALOGS THEREOF, AND METHODS OF USE AND SYNTHESIS TYR, ME1, PNPO LTB4R 401/4885LTB4R2 549/4885RIPK1 4319/4885
US-11639340-B2 Substituted chromanes, analogs thereof, and methods of use and synthesis TYR, ME1, PNPO LTB4R 401/4885LTB4R2 549/4885RIPK1 4319/4885
US-20230339879-A1 SUBSTITUTED CHROMANES, ANALOGS THEREOF, AND METHODS OF USE AND SYNTHESIS TYR, ME1, PNPO LTB4R 401/4885LTB4R2 549/4885RIPK1 4319/4885

“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.