SCHEMBL4834009

SCHEMBL4834009

COc1ccc2c(-c3ccc(Cl)cc3)nnc(Cl)c2c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 1/20 0.48
CNR1 P21554 2/20 0.47
CNR2 P34972 2/20 0.47
GPR55 Q9Y2T6 2/20 0.47
PDE4A P27815 1/20 0.45
PDE4B Q07343 1/20 0.45
PDE4C Q08493 1/20 0.45
PDE4D Q08499 1/20 0.45
KDM4E B2RXH2 3/20 0.44
ALOX12 P18054 2/20 0.42
LMNA P02545 2/20 0.42
TP53 P04637 1/20 0.42
GAA P10253 1/20 0.42
HPGD P15428 1/20 0.42
ALOX15 P16050 1/20 0.42
MAPK1 P28482 1/20 0.42
HSD17B10 Q99714 1/20 0.42
NPSR1 Q6W5P4 4/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41

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
SCHEMBL4122604 0.94 PDE4A (0.47) DHODHCNR1CNR2GPR55PDE4A
SCHEMBL4834600 0.91 ALDH1A1 (0.49) CNR1CNR2GPR55LMNAHPGD
SCHEMBL4834669 0.90 HTT (0.48) CNR1CNR2GPR55PDE4APDE4B
SCHEMBL4840317 0.88 PDE4A (0.46) DHODHCNR1CNR2GPR55PDE4A
SCHEMBL4840257 0.88 MAPK14 (0.46) DHODHPDE4APDE4BPDE4CPDE4D
SCHEMBL4843388 0.88 PDE4A (0.55) CNR1CNR2PDE4APDE4BPDE4C
SCHEMBL4845442 0.88 PDE4A (0.57) PDE4APDE4BPDE4CPDE4DKDM4E
SCHEMBL4842181 0.86 PDE4A (0.43) PDE4APDE4BPDE4CPDE4DKDM4E
SCHEMBL4843630 0.86 PDE4A (0.45) DHODHCNR1CNR2GPR55PDE4A
SCHEMBL4843462 0.85 ALDH1A1 (0.47) DHODHPDE4APDE4BPDE4CPDE4D

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 DHODH 1023/4885CNR1 1058/4885CNR2 1397/4885

“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.