SCHEMBL15747494

SCHEMBL15747494

Nc1cc(Nc2ccc(OC(F)F)c(F)c2)nc(-c2c(C3CC3)nc3ccc(F)cn23)n1

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CYP11B1 P15538 7/20 0.33
▸ CYP11B2 P19099 7/20 0.33
▸ CYP19A1 P11511 2/20 0.32
▸ AGPAT2 O15120 2/20 0.32
▸ ABCB1 P08183 1/20 0.31
▸ ABCC1 P33527 1/20 0.31
▸ ABCG2 Q9UNQ0 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ ROCK2 O75116 1/20 0.31
▸ MCHR1 Q99705 4/20 0.31

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
SCHEMBL16740101 0.87 ROCK2 (0.32) CYP11B1CYP11B2CYP19A1AGPAT2CYP3A4
SCHEMBL16540805 0.86 CYP11B1 (0.32) CYP11B1CYP11B2CYP19A1AGPAT2CYP3A4
SCHEMBL18094395 0.83 SCN9A (0.34) CYP11B1CYP11B2CYP19A1CYP3A4MCHR1
SCHEMBL16740061 0.82 CYP11B2 (0.38) CYP11B1CYP11B2CYP19A1CYP3A4MCHR1
SCHEMBL16740289 0.82 CYP11B2 (0.39) CYP11B1CYP11B2CYP19A1CYP3A4ROCK2
SCHEMBL16740371 0.75 ROCK1 (0.38) CYP11B1CYP11B2CYP19A1AGPAT2MCHR1
SCHEMBL15742382 0.74 ROCK1 (0.40) AGPAT2
SCHEMBL16747893 0.74 AGPAT2 (0.36) AGPAT2ABCB1ABCC1ABCG2CYP3A4
SCHEMBL15742791 0.71 BMI1 (0.49) ROCK2
SCHEMBL16740324 0.71 CYP11B2 (0.41) CYP11B1CYP11B2CYP19A1MCHR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11180483-B2 Substituted reverse pyrimidine Bmi-1 inhibitors PTC THERAPEUTICS, INC. (US) 2021-11-23 — — US claimed
EP-2922828-B1 4,6-DIAMINO-PYRIMIDINE DERIVATIVES AS BMI-1 INHIBITORS FOR TREATING CANCER PTC THERAPEUTICS INC (US) 2020-07-08 — — EP claimed
US-10428050-B2 Substituted reverse pyrimidine Bmi-1 inhibitors PTC THERAPEUTICS, INC. (US) 2019-10-01 — — US claimed
US-20150315182-A1 SUBSTITUTED REVERSE PYRIMIDINE BMI-1 INHIBITORS PTC THERAPEUTICS, INC. 2015-11-05 — — US claimed
US-20220064150-A1 SUBSTITUTED REVERSE PYRIMIDINE BMI-1 INHIBITORS PTC THERAPEUTICS INC (US) 2022-03-03 — — US disclosed
US-20220064150-A1 SUBSTITUTED REVERSE PYRIMIDINE BMI-1 INHIBITORS PTC THERAPEUTICS INC (US) 2022-03-03 — — US disclosed
US-11180483-B2 Substituted reverse pyrimidine Bmi-1 inhibitors PTC THERAPEUTICS, INC. (US) 2021-11-23 — — US disclosed
US-11180483-B2 Substituted reverse pyrimidine Bmi-1 inhibitors PTC THERAPEUTICS, INC. (US) 2021-11-23 — — US disclosed
EP-2922828-B1 4,6-DIAMINO-PYRIMIDINE DERIVATIVES AS BMI-1 INHIBITORS FOR TREATING CANCER PTC THERAPEUTICS INC (US) 2020-07-08 — — EP disclosed
EP-2922828-B1 4,6-DIAMINO-PYRIMIDINE DERIVATIVES AS BMI-1 INHIBITORS FOR TREATING CANCER PTC THERAPEUTICS INC (US) 2020-07-08 — — EP disclosed
US-10428050-B2 Substituted reverse pyrimidine Bmi-1 inhibitors PTC THERAPEUTICS, INC. (US) 2019-10-01 — — US disclosed
US-10428050-B2 Substituted reverse pyrimidine Bmi-1 inhibitors PTC THERAPEUTICS, INC. (US) 2019-10-01 — — US disclosed
US-20150315182-A1 SUBSTITUTED REVERSE PYRIMIDINE BMI-1 INHIBITORS PTC THERAPEUTICS, INC. 2015-11-05 — — US disclosed
US-20150315182-A1 SUBSTITUTED REVERSE PYRIMIDINE BMI-1 INHIBITORS PTC THERAPEUTICS, INC. 2015-11-05 — — US disclosed
US-20150315182-A1 SUBSTITUTED REVERSE PYRIMIDINE BMI-1 INHIBITORS PTC THERAPEUTICS, INC. 2015-11-05 — — US disclosed
WO-2014081906-A2 SUBSTITUTED REVERSE PYRIMIDINE BMI-1 INHIBITORS PTC THERAPEUTICS, INC. (US) 2014-05-30 — — WO 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 (4 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-11180483-B2 Substituted reverse pyrimidine Bmi-1 inhibitors BMI1, BRPF3, BAZ2A CYP11B1 4314/4885CYP11B2 4696/4885CYP19A1 4016/4885
US-20150315182-A1 SUBSTITUTED REVERSE PYRIMIDINE BMI-1 INHIBITORS BMI1, BRPF3, BAZ2A CYP11B1 4314/4885CYP11B2 4696/4885CYP19A1 4016/4885
US-10428050-B2 Substituted reverse pyrimidine Bmi-1 inhibitors BMI1, BRPF3, BAZ2A CYP11B1 4314/4885CYP11B2 4696/4885CYP19A1 4016/4885
US-20220064150-A1 SUBSTITUTED REVERSE PYRIMIDINE BMI-1 INHIBITORS BMI1, BRPF3, BAZ2A CYP11B1 4314/4885CYP11B2 4696/4885CYP19A1 4016/4885

“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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