SCHEMBL27197571

SCHEMBL27197571

O=C(c1cncc(-c2ccncc2)c1)N1CCCc2ccccc21

nearest known ligand 0.70

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.70
▸ HSD17B10 Q99714 1/20 0.70
▸ AVPR2 P30518 3/20 0.62
▸ OXTR P30559 3/20 0.62
▸ AVPR1A P37288 3/20 0.62
▸ ALDH1A1 P00352 2/20 0.60
▸ STAT3 P40763 1/20 0.59
▸ CHRNB4 P30926 1/20 0.59
▸ CHRNA3 P32297 1/20 0.59
▸ KMT2A Q03164 2/20 0.54
▸ MEN1 O00255 1/20 0.54
▸ CRBN Q96SW2 1/20 0.53
▸ NPSR1 Q6W5P4 1/20 0.53
▸ TSHR P16473 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
SCHEMBL29598108 1.00 POLB (0.70) POLBHSD17B10AVPR2OXTRAVPR1A
SCHEMBL27197579 0.93 POLB (0.70) POLBHSD17B10AVPR2OXTRAVPR1A
SCHEMBL29598193 0.93 POLB (0.70) POLBHSD17B10AVPR2OXTRAVPR1A
SCHEMBL24499976 0.90 POLB (0.80) POLBHSD17B10AVPR2OXTRAVPR1A
SCHEMBL29597092 0.90 POLB (0.80) POLBHSD17B10AVPR2OXTRAVPR1A
SCHEMBL27197599 0.89 POLB (0.64) POLBHSD17B10AVPR2OXTRAVPR1A
SCHEMBL29598005 0.89 POLB (0.64) POLBHSD17B10AVPR2OXTRAVPR1A
SCHEMBL24499960 0.87 POLB (0.62) POLBHSD17B10AVPR2OXTRAVPR1A
SCHEMBL24499929 0.87 POLB (0.61) POLBHSD17B10AVPR2OXTRAVPR1A
SCHEMBL29597660 0.87 POLB (0.61) POLBHSD17B10AVPR2OXTRAVPR1A

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-20240124431-A1 2,3-DIHYDRO-4H-BENZO[B][1,4]OXAZIN-4-YL)(5-(PHENYL)-PYRIDIN-3-YL)METHANONE DERIVATIVES AND SIMILAR COMPOUNDS AS CYP11A1 INHIBITORS FOR THE TREATMENT OF PROSTATE CANCER ORION CORPORATION (FI) 2024-04-18 — — US claimed
US-20240124431-A1 2,3-DIHYDRO-4H-BENZO[B][1,4]OXAZIN-4-YL)(5-(PHENYL)-PYRIDIN-3-YL)METHANONE DERIVATIVES AND SIMILAR COMPOUNDS AS CYP11A1 INHIBITORS FOR THE TREATMENT OF PROSTATE CANCER ORION CORPORATION (FI) 2024-04-18 — — 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-20240124431-A1 2,3-DIHYDRO-4H-BENZO[B][1,4]OXAZIN-4-YL)(5-(PHENYL)-PYRIDIN-3-YL)METHANONE DERIVATIVES AND SIMILAR COMPOUNDS AS CYP11A1 INHIBITORS FOR THE TREATMENT OF PROSTATE CANCER CYP11B1, CYP11B2, SRD5A1 POLB 1415/4885HSD17B10 61/4885AVPR2 1913/4885

“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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