SCHEMBL6770003

SCHEMBL6770003

Cc1nnc(-c2ccc3[nH]cnc(=O)c3c2)o1

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 3/20 0.45
PIM2 Q9P1W9 3/20 0.45
PIM3 Q86V86 2/20 0.45
QPCT Q16769 5/20 0.43
GPR84 Q9NQS5 1/20 0.43
TLR8 Q9NR97 1/20 0.42
TLR7 Q9NYK1 1/20 0.42
GSK3B P49841 2/20 0.41
MAPK14 Q16539 3/20 0.40
LRRK2 Q5S007 1/20 0.40

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
SCHEMBL6766663 0.89 QPCT (0.46) QPCTGPR84MAPK14
SCHEMBL6763933 0.81 HDAC6 (0.55) PIM1PIM2PIM3QPCT
SCHEMBL6769464 0.78 PIM1 (0.33) PIM1PIM2PIM3QPCTGPR84
SCHEMBL6770005 0.78 PARP1 (0.56) PIM1PIM3QPCT
SCHEMBL8622177 0.77 ACVR1 (0.46) PIM1PIM3
SCHEMBL6766667 0.76 PARP1 (0.56) PIM1QPCTGPR84MAPK14
SCHEMBL1507612 0.73 PARP1 (0.54) PIM1
SCHEMBL25195476 0.71 TLR8 (0.46) PIM1PIM2PIM3GPR84TLR8
SCHEMBL8181410 0.70 TLR8 (0.56) PIM1PIM2PIM3GPR84TLR8
SCHEMBL6773423 0.69 ACVR1 (0.33) QPCT

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-6828320-B2 Enzyme inhibitors; anticancer agents SMITHKLINE BEECHAM CORPORATION 2004-12-07 US disclosed
US-20020147214-A1 Heterocyclic compounds NOVARTIS AG (CH) 2002-10-10 US disclosed
US-6391874-B1 ANTICARCINOGENIC AGENTS; SKIN DISORDERS SMITHKLINE BEECHAM CORPORATION 2002-05-21 US disclosed
EP-0912559-A1 FUSED HETEROCYCLIC COMPOUNDS AS PROTEIN TYROSINE KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 1999-05-06 EP disclosed
WO-1998002434-A1 FUSED HETEROCYCLIC COMPOUNDS AS PROTEIN TYROSINE KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 1998-01-22 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-20020147214-A1 Heterocyclic compounds BRAF, ABL1, CSK PIM1 401/4885PIM2 383/4885PIM3 487/4885

“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.