SCHEMBL17207648

SCHEMBL17207648

N#Cc1ccc(-c2cnnc(N3CCNCC3)n2)cn1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP11B2 P19099 5/20 0.58
▸ KMT2A Q03164 2/20 0.50
▸ ATM Q13315 1/20 0.50
▸ ALDH1A1 P00352 5/20 0.49
▸ KDM4E B2RXH2 1/20 0.49
▸ POLB P06746 1/20 0.49
▸ GAA P10253 1/20 0.49
▸ UBE2N P61088 1/20 0.49
▸ MAPT P10636 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ CHEK1 O14757 1/20 0.45
▸ NPC1 O15118 1/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ PIM1 P11309 2/20 0.40
▸ HRH4 Q9H3N8 1/20 0.39
▸ HRH3 Q9Y5N1 1/20 0.39
▸ ATR Q13535 1/20 0.38
▸ EGLN1 Q9GZT9 1/20 0.38
▸ MAPKAPK2 P49137 1/20 0.37
▸ MTOR P42345 1/20 0.36

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
SCHEMBL18489951 0.83 CYP11B2 (0.59) CYP11B2KMT2AATMALDH1A1KDM4E
SCHEMBL18791092 0.79 ROCK2 (0.50) CYP11B2KMT2AATMALDH1A1KDM4E
SCHEMBL18502896 0.77 ALDH1A1 (0.56) CYP11B2KMT2AATMALDH1A1KDM4E
SCHEMBL17207718 0.77 CYP11B2 (0.59) CYP11B2ALDH1A1MAPTSMN1; SMN2NPC1
SCHEMBL17207592 0.77 CYP11B2 (0.59) CYP11B2
SCHEMBL20402779 0.76 ALDH1A1 (0.73) CYP11B2KMT2AATMALDH1A1KDM4E
SCHEMBL24989033 0.75 CHRNB2 (0.49) CHEK1PIM1MAPKAPK2
SCHEMBL17207654 0.74 CYP11B2 (1.00) CYP11B2ALDH1A1KDM4ESMN1; SMN2
SCHEMBL18508207 0.73 CYP11B2 (0.55) CYP11B2ALDH1A1MAPTSMN1; SMN2NPC1
SCHEMBL718760 0.71 CHRNB2 (0.58) CHEK1PIM1

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
US-10029993-B2 Disubstituted 1, 2, 4-triazine compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2018-07-24 — — US disclosed
EP-3135668-A1 NOVEL DISUBSTITUTED 1, 2, 4-TRIAZINE COMPOUND Mitsubishi Tanabe Pharma Corporation (JP) 2017-03-01 — — EP disclosed
US-20170044115-A1 NOVEL DISUBSTITUTED 1, 2, 4-TRIAZINE COMPOUND MITSUBISHI TANABE PHARMA CORPORATION (JP) 2017-02-16 — — US disclosed
WO-2015163427-A1 NOVEL DISUBSTITUTED 1, 2, 4-TRIAZINE COMPOUND 田辺三菱製薬株式会社 2015-10-29 — — 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 (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-20170044115-A1 NOVEL DISUBSTITUTED 1, 2, 4-TRIAZINE COMPOUND NR3C2, REN, CYP21A2 CYP11B2 17/4885KMT2A 2905/4885ATM 4801/4885
US-10029993-B2 Disubstituted 1, 2, 4-triazine compound NR3C2, REN, NR5A1 CYP11B2 19/4885KMT2A 2546/4885ATM 4738/4885

“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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