SCHEMBL4722757

SCHEMBL4722757

COCc1nnc(NC2CCN(Cc3ccc(OCCCN(C)C)c(F)c3)CC2)c2cc(OC)ccc12

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 5/20 0.48
KCNH2 Q12809 2/20 0.48
EHMT2 Q96KQ7 13/20 0.47
KDM1A O60341 9/20 0.47
RCOR1 Q9UKL0 9/20 0.47
EZH2 Q15910 1/20 0.44
PRMT1 Q99873 1/20 0.44
KMT5A Q9NQR1 1/20 0.44
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
NSD2 O96028 1/20 0.41
EHMT1 Q9H9B1 1/20 0.40
DNMT3A Q9Y6K1 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
Hydrochloric Acid SCHEMBL4124977 0.99 MCHR1 (0.48) MCHR1KCNH2EHMT2KDM1ARCOR1
SCHEMBL4763996 0.93 MCHR1 (0.49) MCHR1KCNH2EHMT2KDM1ARCOR1
Hydrochloric Acid SCHEMBL4122837 0.93 MCHR1 (0.48) MCHR1KCNH2EHMT2KDM1ARCOR1
SCHEMBL4723156 0.90 EHMT2 (0.48) EHMT2KDM1ARCOR1EZH2PRMT1
Hydrochloric Acid SCHEMBL4124958 0.89 EHMT2 (0.47) EHMT2KDM1ARCOR1EZH2PRMT1
SCHEMBL4767141 0.88 MCHR1 (0.48) MCHR1KCNH2EHMT2KDM1ARCOR1
Hydrochloric Acid SCHEMBL4133525 0.88 MCHR1 (0.48) MCHR1KCNH2EHMT2KDM1ARCOR1
SCHEMBL5310692 0.85 EHMT2 (0.51) MCHR1KCNH2EHMT2KDM1ARCOR1
SCHEMBL4723649 0.83 EHMT2 (0.44) MCHR1EHMT2KDM1ARCOR1EZH2
Hydrochloric Acid SCHEMBL4116507 0.83 EHMT2 (0.43) MCHR1EHMT2KDM1ARCOR1EZH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1940823-A2 SUBSTITUTED 1-AMINO-PHTHALZINE DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF Sanofi-Aventis (FR) 2008-07-09 EP claimed
WO-2007042660-A2 SUBSTITUTED 1-AMINO-PHTHALZINE DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2007-04-19 WO claimed
US-20090124624-A1 SUBSTITUTED 1-AMINOPHTHALAZINE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC APPLICATION THEREOF SANOFI-AVENTIS (FR) 2009-05-14 US disclosed
US-20090124624-A1 SUBSTITUTED 1-AMINOPHTHALAZINE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC APPLICATION THEREOF SANOFI-AVENTIS (FR) 2009-05-14 US disclosed
EP-1940823-A2 SUBSTITUTED 1-AMINO-PHTHALZINE DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF Sanofi-Aventis (FR) 2008-07-09 EP disclosed
WO-2007042660-A2 SUBSTITUTED 1-AMINO-PHTHALZINE DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2007-04-19 WO disclosed
WO-2007042660-A2 SUBSTITUTED 1-AMINO-PHTHALZINE DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2007-04-19 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-20090124624-A1 SUBSTITUTED 1-AMINOPHTHALAZINE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC APPLICATION THEREOF AGTR1, AGTR2, AHR MCHR1 138/4885KCNH2 1092/4885EHMT2 993/4885

“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.