SCHEMBL22992635

SCHEMBL22992635

COC(=O)c1ccc2nc(CCl)n(Cc3cccn3C)c2c1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ DRD2 P14416 6/20 0.45
▸ TBXA2R P21731 6/20 0.45
▸ ACSS2 Q9NR19 1/20 0.45
▸ KDM4E B2RXH2 1/20 0.40
▸ CFTR P13569 2/20 0.39
▸ ALOX15 P16050 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ EHMT2 Q96KQ7 1/20 0.38
▸ PPARG P37231 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38

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
SCHEMBL31159736 0.84 GLP1R (0.45) DRD2TBXA2RACSS2KDM4E
SCHEMBL20266537 0.84 GLP1R (0.45) DRD2TBXA2RACSS2KDM4E
Hydrochloric Acid SCHEMBL30269640 0.84 GLP1R (0.44) DRD2TBXA2RACSS2KDM4E
Hydrochloric Acid SCHEMBL28910361 0.84 GLP1R (0.44) DRD2TBXA2RACSS2KDM4E
SCHEMBL30269261 0.81 ALOX5AP (0.44) DRD2TBXA2RACSS2KDM4E
SCHEMBL29559474 0.80 TLR7 (0.48) DRD2TBXA2RACSS2KDM4EHTT
SCHEMBL20280108 0.80 TLR7 (0.48) DRD2TBXA2RACSS2KDM4EHTT
SCHEMBL24265281 0.80 ACSS2 (0.49) DRD2TBXA2RACSS2KDM4ECFTR
Hydrochloric Acid SCHEMBL20266404 0.79 TLR7 (0.47) DRD2TBXA2RACSS2KDM4EHTT
SCHEMBL29040863 0.79 DNMT1 (0.46) DRD2TBXA2RACSS2KDM4EMEN1

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-20210047298-A1 GLP-1 RECEPTOR AGONISTS AND USES THEREOF PFIZER INC. (US) 2021-02-18 — — 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-20210047298-A1 GLP-1 RECEPTOR AGONISTS AND USES THEREOF GLP1R, GIPR, GPR119 DRD2 3291/4885TBXA2R 130/4885ACSS2 1602/4885

“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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