SCHEMBL4919219

SCHEMBL4919219

CCCN1Cc2nc3c(-c4cccnc4C)cccc3c(N)c2C1=O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 2/20 0.36
▸ LMNA P02545 1/20 0.36
▸ PARP1 P09874 1/20 0.36
▸ PARP2 Q9UGN5 1/20 0.36
▸ GRM1 Q13255 2/20 0.35
▸ GRM5 P41594 1/20 0.35
▸ MAPT P10636 2/20 0.33
▸ RAB9A P51151 2/20 0.33
▸ GAA P10253 1/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ USP2 O75604 1/20 0.33
▸ RECQL P46063 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ ADORA2A P29274 2/20 0.33
▸ ALDH1A1 P00352 2/20 0.32
▸ GABRG2 P18507 2/20 0.32
▸ GABRB3 P28472 2/20 0.32

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
SCHEMBL2658389 0.91 GRM1 (0.38) HTTLMNAPARP1PARP2GRM1
SCHEMBL2660747 0.88 LMNA (0.35) HTTLMNAPARP1PARP2GRM1
SCHEMBL4915502 0.88 LMNA (0.36) HTTLMNAPARP1PARP2MAPT
SCHEMBL4922433 0.87 PIK3CA (0.36) HTTLMNAPARP1PARP2MAPT
SCHEMBL4920766 0.87 NPC1 (0.38) HTTLMNAPARP1PARP2MAPT
SCHEMBL2660780 0.87 GABRG2 (0.42) HTTLMNAPARP1PARP2GAA
SCHEMBL2660762 0.86 HTT (0.35) HTTLMNAPARP1PARP2RAB9A
SCHEMBL2655382 0.86 LMNA (0.38) HTTLMNAPARP1PARP2GAA
SCHEMBL4922388 0.85 LCK (0.47) HTTLMNAPARP1PARP2GABRG2
SCHEMBL2661723 0.85 CRHR1 (0.35) HTTLMNAPARP1PARP2GAA

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-20080318943-A1 Compounds and Uses Thereof - 848 ASTRAZENECA AB (SE) 2008-12-25 — — US claimed
US-20080318943-A1 Compounds and Uses Thereof - 848 ASTRAZENECA AB (SE) 2008-12-25 — — 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-20080318943-A1 Compounds and Uses Thereof - 848 COMT, BACE1, BDNF HTT 503/4885LMNA 1909/4885PARP1 1350/4885

“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.

Send feedback