SCHEMBL6645162

SCHEMBL6645162

Cc1cccc2c(=O)[nH]c(C3CCN(C)C3)cc12

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 3/20 0.46
PARP14 Q460N5 3/20 0.46
TNKS O95271 10/20 0.46
KDM4E B2RXH2 1/20 0.41
ATM Q13315 1/20 0.41
CCNT1 O60563 1/20 0.39
CDK9 P50750 1/20 0.39

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
SCHEMBL6646094 0.92 TNKS (0.50) PARP1PARP14TNKSCCNT1CDK9
SCHEMBL13107353 0.84 PARP1 (0.49) PARP1PARP14TNKSCCNT1CDK9
SCHEMBL13107354 0.84 PARP1 (0.49) PARP1PARP14TNKSCCNT1CDK9
SCHEMBL3441929 0.84 PARP1 (0.49) PARP1PARP14TNKSCCNT1CDK9
SCHEMBL6645436 0.83 PARP1 (0.44) PARP1PARP14TNKS
SCHEMBL3443059 0.83 PARP1 (0.48) PARP1TNKSCCNT1CDK9
SCHEMBL6642750 0.82 PARP1 (0.43) PARP1PARP14TNKS
SCHEMBL6644488 0.82 KDM4E (0.46) PARP1PARP14TNKSKDM4EATM
SCHEMBL3442404 0.81 TNKS (0.54) PARP1TNKSATM
SCHEMBL6647500 0.81 TNKS (0.46) PARP1PARP14TNKS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040176361-A1 Fused heterocyclic compound and medicinal use thereof MITSUBISHI PHARMA CORPORATION (JP) 2004-09-09 US claimed
EP-1396488-A1 FUSED HETEROCYCLIC COMPOUND AND MEDICINAL USE THEREOF Mitsubishi Pharma Corporation (JP) 2004-03-10 EP claimed
US-20040176361-A1 Fused heterocyclic compound and medicinal use thereof MITSUBISHI PHARMA CORPORATION (JP) 2004-09-09 US disclosed
EP-1396488-A1 FUSED HETEROCYCLIC COMPOUND AND MEDICINAL USE THEREOF Mitsubishi Pharma Corporation (JP) 2004-03-10 EP 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-20040176361-A1 Fused heterocyclic compound and medicinal use thereof PARP11, PARP1, CD38 PARP1 2/4885PARP14 10/4885TNKS 121/4885

“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.