SCHEMBL4837308

SCHEMBL4837308

COc1ccc(OC)c(-c2nnc(NC3CCN(Cc4ccc5ncsc5c4)CC3)c3cc(OC)ccc23)c1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DNMT3A Q9Y6K1 2/20 0.45
MCHR1 Q99705 4/20 0.44
EHMT2 Q96KQ7 5/20 0.42
HRH1 P35367 1/20 0.42
CCR3 P51677 1/20 0.42
SSTR5 P35346 3/20 0.42
NSD2 O96028 4/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
KDM1A O60341 1/20 0.40
RCOR1 Q9UKL0 1/20 0.40

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
SCHEMBL4834586 0.90 ACHE (0.48) DNMT3AMCHR1EHMT2HRH1CCR3
SCHEMBL5193262 0.84 EHMT2 (0.54) DNMT3AMCHR1EHMT2NSD2MEN1
Hydrochloric Acid SCHEMBL4839148 0.83 EHMT2 (0.53) DNMT3AMCHR1EHMT2NSD2MEN1
SCHEMBL5195218 0.82 MCHR1 (0.64) MCHR1
Hydrochloric Acid SCHEMBL4843807 0.81 MCHR1 (0.63) MCHR1
SCHEMBL5195313 0.81 MCHR1 (0.45) DNMT3AMCHR1EHMT2HRH1SSTR5
Hydrochloric Acid SCHEMBL4839475 0.80 MCHR1 (0.44) DNMT3AMCHR1EHMT2HRH1SSTR5
SCHEMBL4843124 0.79 EHMT2 (0.54) DNMT3AMCHR1EHMT2NSD2MEN1
SCHEMBL5193639 0.78 EHMT2 (0.54) DNMT3AMCHR1EHMT2NSD2MEN1
SCHEMBL4841940 0.77 ACHE (0.49) DNMT3AMCHR1EHMT2NSD2MEN1

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 6 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 claimed
EP-1737840-B1 1-AMINO-PHTHALAZINE DERIVATIVES, THE PREPARATION AND THE THERAPEUTIC USE THEREOF SANOFI AVENTIS (FR) 2007-09-12 EP claimed
US-20070099895-A1 1-AMINO-PHTHALAZINE DERIVATIVES, THE PREPARATION AND THE THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2007-05-03 US claimed
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

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 4219/4885MCHR1 1335/4885EHMT2 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.