SCHEMBL20135057

SCHEMBL20135057

Cc1ccc(C2(C)CC(=O)NC2=O)cc1

nearest known ligand 0.71

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CYP19A1 P11511 7/20 0.71
▸ TSHR P16473 1/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ CCR2 P41597 1/20 0.37
▸ MGAT2 Q10469 1/20 0.37
▸ ALOX5 P09917 1/20 0.37
▸ SLC6A2 P23975 1/20 0.36
▸ SLC6A4 P31645 1/20 0.36
▸ SLC6A3 Q01959 1/20 0.36
▸ KCNH2 Q12809 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ PKM P14618 1/20 0.35
▸ HPGD P15428 1/20 0.34
▸ CRBN Q96SW2 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
SCHEMBL10971053 0.83 CYP19A1 (0.69) CYP19A1TSHRNPSR1CCR2SLC6A2
SCHEMBL19074638 0.83 CYP19A1 (1.00) CYP19A1
SCHEMBL1568276 0.82 CYP19A1 (0.68) CYP19A1TSHRNPSR1CCR2KCNH2
SCHEMBL14341950 0.80 CYP19A1 (0.65) CYP19A1TSHRMAPTCRBN
SCHEMBL20135070 0.79 CYP19A1 (0.63) CYP19A1TSHRPKMCRBN
SCHEMBL20135419 0.77 CYP19A1 (0.53) CYP19A1MGAT2SLC6A2SLC6A4SLC6A3
SCHEMBL5970207 0.75 CYP19A1 (0.58) CYP19A1NPSR1MAPTCRBN
SCHEMBL20135217 0.73 CYP19A1 (0.73) CYP19A1TSHRNPSR1
SCHEMBL3402258 0.67 CCR2 (0.36) CYP19A1CCR2MGAT2SLC6A2SLC6A4
SCHEMBL19585699 0.66 CYP19A1 (0.70) CYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107922347-B Novel imide derivatives and their use as pharmaceuticals 田边三菱制药株式会社 2022-06-28 — — CN disclosed
US-10407408-B2 Imide derivatives and use thereof as medicine MITSUBISHI TANABE PHARMA CORPORATION (JP) 2019-09-10 — — US disclosed
US-20190077787-A1 NOVEL IMIDE DERIVATIVES AND USE THEREOF AS MEDICINE MITSUBISHI TANABE PHARMA CORPORATION (JP) 2019-03-14 — — US disclosed
EP-3321256-A1 NOVEL IMIDE DERIVATIVES AND USE THEREOF AS MEDICINE Mitsubishi Tanabe Pharma Corporation (JP) 2018-05-16 — — EP 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 (2 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-20190077787-A1 NOVEL IMIDE DERIVATIVES AND USE THEREOF AS MEDICINE MMP9, MMP10, MMP1 CYP19A1 2754/4885TSHR 3522/4885NPSR1 3673/4885
US-10407408-B2 Imide derivatives and use thereof as medicine MMP9, MMP2, MMP1 CYP19A1 2331/4885TSHR 3141/4885NPSR1 3795/4885

“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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