SCHEMBL6685976

SCHEMBL6685976

O=c1[nH]c2ccc(S(=O)(=O)NCCN3CCOCC3)cc2c2ccccc12

nearest known ligand 0.81

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 9/20 0.81
ALDH1A1 P00352 1/20 0.56
MAPK1 P28482 1/20 0.56
PARG Q86W56 1/20 0.54
POLB P06746 1/20 0.53
MET P08581 2/20 0.53
HPGD P15428 1/20 0.52
PKM P14618 1/20 0.51

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
SCHEMBL6694764 0.89 PARP1 (1.00) PARP1MAPK1PARG
Hydrochloric Acid SCHEMBL6686733 0.88 PARP1 (1.00) PARP1MAPK1PARG
Hydrochloric Acid SCHEMBL6686732 0.88 PARP1 (0.96) PARP1MAPK1PARG
SCHEMBL13705056 0.82 POLB (0.64) PARP1ALDH1A1POLB
SCHEMBL6690145 0.81 PARP1 (0.65) PARP1ALDH1A1MAPK1POLBPKM
SCHEMBL2763527 0.80 PARP1 (0.90) PARP1ALDH1A1MAPK1POLBHPGD
SCHEMBL3719058 0.75 PKM (0.69) ALDH1A1MAPK1POLBPKM
SCHEMBL5605356 0.75 ALDH1A1 (0.69) ALDH1A1MAPK1POLBPKM
SCHEMBL2769748 0.75 PARP1 (1.00) PARP1ALDH1A1POLB
SCHEMBL29363040 0.75 PARP1 (1.00) PARP1ALDH1A1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6723733-B2 POLYMERASE INHIBITOR GUILFORD PHARMACEUTICALS, INC. 2004-04-20 US disclosed
US-20020006927-A1 Sulfonamide and carbamide derivatives of 6(5H)phenanthridinones and their uses EISAI INC. 2002-01-17 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-20020006927-A1 Sulfonamide and carbamide derivatives of 6(5H)phenanthridinones and their uses PARP1, PARP2, PARP6 PARP1 1/4885ALDH1A1 1532/4885MAPK1 4036/4885

“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.