SCHEMBL23810852

SCHEMBL23810852

CC(C)(C)OC(=O)Cn1ccc2cc(Br)ccc21

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ NTSR1 P30989 1/20 0.51
▸ HTR2A P28223 1/20 0.48
▸ HTR2C P28335 1/20 0.48
▸ KRAS P01116 7/20 0.46
▸ ATM Q13315 1/20 0.42
▸ FPR2 P25090 3/20 0.42
▸ HTR7 P34969 1/20 0.41
▸ AR P10275 1/20 0.41
▸ ROCK2 O75116 1/20 0.41
▸ HDAC6 Q9UBN7 2/20 0.40
▸ FABP3 P05413 1/20 0.39
▸ FABP2 P12104 1/20 0.39
▸ FABP4 P15090 1/20 0.39
▸ FABP5 Q01469 1/20 0.39

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
SCHEMBL25338022 0.89 HTR7 (0.44) NTSR1FPR2HTR7HDAC6
SCHEMBL21810428 0.85 NTSR1 (0.57) NTSR1HTR2AHTR2CKRASATM
SCHEMBL13836584 0.84 NTSR1 (0.51) NTSR1ATMROCK2HDAC6
SCHEMBL5069199 0.83 PLA2G4A (0.55) ATMROCK2HDAC6
SCHEMBL4485443 0.82 NTSR1 (0.52) NTSR1HTR2AHTR2CKRASATM
SCHEMBL19470070 0.82 PLA2G4A (0.43) ATMROCK2HDAC6
SCHEMBL20676201 0.81 KRAS (0.47) NTSR1HTR2AHTR2CKRASHTR7
SCHEMBL27844158 0.81 NPY5R (0.45) ATMROCK2HDAC6
SCHEMBL3597779 0.80 KMT2A (0.59) NTSR1HTR2AHTR2C
SCHEMBL30229742 0.80 KMT2A (0.59) NTSR1HTR2AHTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11542273-B2 Amide compound having bet proteolysis-inducing action and medicinal application thereof MITSUBISHI TANABE PHARMA CORPORATION (JP) 2023-01-03 — — US disclosed
US-20210284654-A1 AMIDE COMPOUND HAVING BET PROTEOLYSIS-INDUCING ACTION AND MEDICINAL APPLICATION THEREOF MITSUBISHI TANABE PHARMA CORPORATION (JP) 2021-09-16 — — 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 (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-11542273-B2 Amide compound having bet proteolysis-inducing action and medicinal application thereof BET1, BRD4, PHKB NTSR1 4591/4885HTR2A 4152/4885HTR2C 4522/4885
US-20210284654-A1 AMIDE COMPOUND HAVING BET PROTEOLYSIS-INDUCING ACTION AND MEDICINAL APPLICATION THEREOF BET1, BRD4, PHKB NTSR1 4587/4885HTR2A 4156/4885HTR2C 4530/4885

“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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