SCHEMBL6373389

SCHEMBL6373389

O=C(Cc1n[nH]c(=O)c2c1CCCC2)NCCNC1CCCCC1

nearest known ligand 0.56

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ PARP1 P09874 19/20 0.56
▸ NPC1 O15118 1/20 0.40
▸ RAB9A P51151 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
Bromide SCHEMBL1251937 0.99 PARP1 (0.55) PARP1NPC1RAB9A
SCHEMBL6374708 0.99 PARP1 (0.54) PARP1
Bromide SCHEMBL1251641 0.98 PARP1 (0.53) PARP1
SCHEMBL1252619 0.96 PARP1 (0.54) PARP1
SCHEMBL1251301 0.95 PARP1 (0.54) PARP1
SCHEMBL1252947 0.93 PARP1 (0.54) PARP1
SCHEMBL1252555 0.93 PARP1 (0.54) PARP1
Bromide SCHEMBL1249847 0.92 PARP1 (0.53) PARP1
SCHEMBL6378632 0.92 PARP1 (0.52) PARP1
SCHEMBL6379728 0.92 PARP1 (0.52) PARP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050085476-A1 Fused pyridazine derivative compounds and drugs containing the compounds as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2005-04-21 — — 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-20050085476-A1 Fused pyridazine derivative compounds and drugs containing the compounds as the active ingredient MUSK, RNASE1, DPYD PARP1 4/4885NPC1 4197/4885RAB9A 4428/4885

“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