SCHEMBL4993759

SCHEMBL4993759

NC(=O)c1cccc(-c2ccco2)c1

nearest known ligand 0.73

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.73
HDAC2 Q92769 1/20 0.49
KAT6A Q92794 1/20 0.48
PARP1 P09874 5/20 0.47
MYC P01106 3/20 0.46
ERN1 O75460 2/20 0.45
PRMT6 Q96LA8 1/20 0.44
PRKCI P41743 1/20 0.43
TAAR1 Q96RJ0 2/20 0.43

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
SCHEMBL27605185 0.86 KEAP1 (0.77) KEAP1HDAC2KAT6AERN1PRMT6
SCHEMBL941410 0.84 KEAP1 (1.00) KEAP1HDAC2KAT6A
SCHEMBL17777307 0.83 KEAP1 (0.73) KEAP1HDAC2KAT6AERN1PRMT6
SCHEMBL4964453 0.80 TAAR1 (0.57) KEAP1HDAC2PARP1MYCERN1
SCHEMBL28990328 0.80 KEAP1 (0.69) KEAP1HDAC2KAT6AERN1PRMT6
SCHEMBL16810390 0.79 MYC (0.73) KEAP1MYC
SCHEMBL2431097 0.79 PARP1 (0.64) PARP1ERN1
SCHEMBL31422694 0.79 PARP1 (0.64) PARP1ERN1
SCHEMBL17773161 0.79 KEAP1 (0.67) KEAP1HDAC2KAT6AERN1PRMT6
SCHEMBL18311308 0.79 KAT6A (0.55) KEAP1HDAC2KAT6APARP1MYC

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-2131656-A2 PHTHALAZINE DERIVATIVES Forest Laboratories Holdings Limited (BM) 2009-12-16 EP claimed
US-20080146547-A1 PHTHALAZINE DERIVATIVES FOREST LABORATORIES HOLDINGS LIMITED (BM) 2008-06-19 US claimed
WO-2008061108-A2 PHTHALAZINE DERIVATIVES FOREST LABORATORIES HOLDINGS LIMITED (BM) 2008-05-22 WO claimed
US-8349836-B2 Phthalazine derivatives as inhibitors of protein kinase ARALDI GIAN-LUCA (US) 2013-01-08 US disclosed
EP-2131656-A2 PHTHALAZINE DERIVATIVES Forest Laboratories Holdings Limited (BM) 2009-12-16 EP disclosed
US-20080146547-A1 PHTHALAZINE DERIVATIVES FOREST LABORATORIES HOLDINGS LIMITED (BM) 2008-06-19 US disclosed
WO-2008061108-A2 PHTHALAZINE DERIVATIVES FOREST LABORATORIES HOLDINGS LIMITED (BM) 2008-05-22 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-20080146547-A1 PHTHALAZINE DERIVATIVES CDK5, HIPK2, PACSIN2 KEAP1 170/4885HDAC2 106/4885KAT6A 735/4885

“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.