SCHEMBL4842648

SCHEMBL4842648

COc1ccc(-c2nnc(NC3CCN(Cc4ccccc4)CC3)c3cc(OC)cc(OC)c23)cc1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DNMT3A Q9Y6K1 3/20 0.54
NSD2 O96028 7/20 0.54
EHMT2 Q96KQ7 8/20 0.51
KDM1A O60341 1/20 0.51
RCOR1 Q9UKL0 1/20 0.51
ACHE P22303 1/20 0.50
EZH2 Q15910 1/20 0.50
NSD3 Q9BZ95 1/20 0.50
EHMT1 Q9H9B1 1/20 0.50
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
SIGMAR1 Q99720 1/20 0.49

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
SCHEMBL5196985 0.91 KDM1A (0.51) DNMT3ANSD2EHMT2KDM1ARCOR1
Hydrochloric Acid SCHEMBL4834537 0.91 KDM1A (0.51) DNMT3ANSD2EHMT2KDM1ARCOR1
SCHEMBL4124605 0.87 DNMT3A (0.60) DNMT3ANSD2EHMT2KDM1ARCOR1
SCHEMBL4125007 0.85 NSD2 (0.55) DNMT3ANSD2EHMT2KDM1ARCOR1
SCHEMBL5196850 0.82 ACHE (0.58) DNMT3ANSD2EHMT2ACHEEHMT1
Hydrochloric Acid SCHEMBL4841854 0.81 ACHE (0.57) DNMT3ANSD2EHMT2ACHEEHMT1
SCHEMBL4843291 0.81 NSD2 (0.59) DNMT3ANSD2EHMT2KDM1ARCOR1
SCHEMBL4838622 0.80 DNMT3A (0.58) DNMT3ANSD2EHMT2KDM1ARCOR1
SCHEMBL5193700 0.80 ACHE (0.56) DNMT3AEHMT2KDM1ARCOR1ACHE
SCHEMBL4843272 0.79 EHMT2 (0.53) DNMT3ANSD2EHMT2KDM1ARCOR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7423030-B2 1-amino-phthalazine derivatives, the preparation and the therapeutic use thereof SANOFI-AVENTIS (FR) 2008-09-09 US disclosed
EP-1737840-B1 1-AMINO-PHTHALAZINE DERIVATIVES, THE PREPARATION AND THE THERAPEUTIC USE THEREOF SANOFI AVENTIS (FR) 2007-09-12 EP disclosed
US-20070099895-A1 1-AMINO-PHTHALAZINE DERIVATIVES, THE PREPARATION AND THE THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2007-05-03 US disclosed
EP-1737840-A1 1-AMINO-PHTHALAZINE DERIVATIVES, THE PREPARATION AND THE THERAPEUTIC USE THEREOF Sanofi-Aventis (FR) 2007-01-03 EP disclosed
WO-2005103033-A1 1-AMINO-PHTHALAZINE DERIVATIVES, THE PREPARATION AND THE THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2005-11-03 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 (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-20070099895-A1 1-AMINO-PHTHALAZINE DERIVATIVES, THE PREPARATION AND THE THERAPEUTIC USE THEREOF CYP11B2, CYP11B1, GOT2 DNMT3A 4219/4885NSD2 1193/4885EHMT2 1339/4885

“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.