SCHEMBL6374684

SCHEMBL6374684

Cc1cccc(C)c1-c1cc(Cl)cc2c1OC(CN(C)C(=O)OCc1ccccc1)C2

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 1/20 0.38
AQP1 P29972 1/20 0.35
SIRT2 Q8IXJ6 1/20 0.35
GPBAR1 Q8TDU6 3/20 0.35
CACNA1H O95180 1/20 0.34
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
SIGMAR1 Q99720 1/20 0.34
FFAR1 O14842 1/20 0.34

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
SCHEMBL4596687 0.89 CA1 (0.40) ALDH1A1LMNAFFAR1
SCHEMBL4596601 0.88 MEN1 (0.36) PTGER1AQP1SIRT2GPBAR1CACNA1H
SCHEMBL4231408 0.85 AQP1 (0.40) AQP1SIRT2GPBAR1ALDH1A1LMNA
SCHEMBL4596670 0.85 PRKAB2 (0.37) AQP1SIRT2GPBAR1CACNA1HALDH1A1
SCHEMBL4595335 0.84 GPBAR1 (0.36) PTGER1AQP1GPBAR1CACNA1HALDH1A1
SCHEMBL6367712 0.84 TDP1 (0.41) PTGER1AQP1SIRT2ALDH1A1LMNA
SCHEMBL4224652 0.84 PRKAB2 (0.37) ALDH1A1LMNASIGMAR1
SCHEMBL4233589 0.83 AQP1 (0.38) AQP1ALDH1A1LMNASIGMAR1
SCHEMBL4220797 0.82 FABP4 (0.37) ALDH1A1LMNASIGMAR1
SCHEMBL6373736 0.81 AQP1 (0.46) PTGER1AQP1GPBAR1CACNA1HALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050261347-A1 Dihydrobenzofuranyl alkanamine derivatives and methods for using same WYETH (US) 2005-11-24 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-20050261347-A1 Dihydrobenzofuranyl alkanamine derivatives and methods for using same ADRA2A, HTR2A, ADRA1A PTGER1 513/4885AQP1 2290/4885SIRT2 1953/4885

“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.