SCHEMBL4833670

SCHEMBL4833670

COc1ccc2c(Cc3ccccc3)n[nH]c(=O)c2c1

nearest known ligand 0.66

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 10/20 0.66
AR P10275 2/20 0.65
CYP3A4 P08684 1/20 0.58
CYP2C9 P11712 1/20 0.58
TSHR P16473 1/20 0.58
CYP2C19 P33261 1/20 0.58
LMNA P02545 1/20 0.52
GAA P10253 1/20 0.52
MAPT P10636 1/20 0.52
BRD4 O60885 1/20 0.49
ENPP1 P22413 3/20 0.49
ALDH1A1 P00352 1/20 0.47

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
SCHEMBL4841413 0.88 PARP1 (0.51) PARP1ARCYP3A4CYP2C9TSHR
SCHEMBL6589989 0.88 CYP11B1 (0.53) PARP1ARCYP3A4CYP2C9TSHR
SCHEMBL4837264 0.86 PARP1 (0.52) PARP1ARCYP3A4CYP2C9TSHR
SCHEMBL25548688 0.85 CYP2C9 (0.70) PARP1ARCYP3A4CYP2C9TSHR
SCHEMBL581787 0.85 AR (0.70) PARP1ARCYP3A4CYP2C9TSHR
SCHEMBL6587665 0.84 PARP1 (0.50) PARP1ARCYP3A4CYP2C9TSHR
SCHEMBL4840388 0.83 GAA (0.51) PARP1ARCYP3A4CYP2C9TSHR
SCHEMBL6590866 0.83 TSHR (0.48) PARP1ARCYP3A4CYP2C9TSHR
SCHEMBL4702788 0.82 CYP3A4 (0.53) PARP1ARCYP3A4CYP2C9TSHR
SCHEMBL4117496 0.82 GAA (0.51) ARCYP3A4CYP2C9TSHRCYP2C19

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 PARP1 1732/4885AR 2300/4885CYP3A4 562/4885

“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.