SCHEMBL6080755

SCHEMBL6080755

C=CCOC(=O)c1ccccc1NC(=O)c1c(-c2c(Cl)cccc2Cl)noc1C

nearest known ligand 0.65

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ GHSR Q92847 6/20 0.65
▸ PTGS2 P35354 9/20 0.60
▸ ALDH1A1 P00352 4/20 0.56
▸ LMNA P02545 2/20 0.55
▸ KMT2A Q03164 2/20 0.55
▸ HPGD P15428 1/20 0.53
▸ TSHR P16473 1/20 0.53
▸ SMN1; SMN2 Q16637 1/20 0.53
▸ MEN1 O00255 1/20 0.53
▸ MAPT P10636 2/20 0.53
▸ TP53 P04637 1/20 0.53
▸ KDM4E B2RXH2 1/20 0.53
▸ GAA P10253 1/20 0.53
▸ TDP1 Q9NUW8 1/20 0.53

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
SCHEMBL6081481 0.82 GHSR (0.76) GHSRPTGS2ALDH1A1LMNAKMT2A
SCHEMBL18046665 0.73 PTGS2 (0.61) GHSRPTGS2ALDH1A1LMNAKMT2A
SCHEMBL18046667 0.73 PTGS2 (0.61) GHSRPTGS2ALDH1A1LMNAKMT2A
SCHEMBL29608448 0.73 PTGS2 (0.61) GHSRPTGS2ALDH1A1LMNAKMT2A
SCHEMBL7058846 0.72 TSHR (0.72) GHSRPTGS2ALDH1A1LMNAKMT2A
SCHEMBL6081569 0.72 PTGS2 (0.73) GHSRPTGS2ALDH1A1LMNAKMT2A
SCHEMBL3636891 0.72 GHSR (0.75) GHSRPTGS2ALDH1A1LMNAKMT2A
SCHEMBL16448979 0.71 TSHR (0.66) PTGS2ALDH1A1LMNAKMT2AHPGD
SCHEMBL3631940 0.71 GHSR (1.00) GHSRPTGS2ALDH1A1KMT2AHPGD
SCHEMBL11894104 0.71 POLB (0.77) PTGS2ALDH1A1LMNAKMT2ATSHR

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-20060089398-A1 Isoxazole carboxamide derivatives as ghrelin receptor modulators NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2006-04-27 — — 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-20060089398-A1 Isoxazole carboxamide derivatives as ghrelin receptor modulators GPR119, GIPR, GLP1R GHSR 5/4885PTGS2 2925/4885ALDH1A1 3320/4885

“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.

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