SCHEMBL6798276

SCHEMBL6798276

O=c1[nH]c(CCCNCc2ccc(-c3ccccc3)cc2)nc2ccccc12

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 6/20 0.57
SMN1; SMN2 Q16637 2/20 0.56
MAPT P10636 2/20 0.54
PDE10A Q9Y233 6/20 0.52
ALDH1A1 P00352 1/20 0.52
KMT2A Q03164 1/20 0.51
PARP2 Q9UGN5 1/20 0.51
NPC1 O15118 1/20 0.50
GAA P10253 1/20 0.50
RAB9A P51151 1/20 0.50
TNKS2 Q9H2K2 1/20 0.49

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
SCHEMBL6790215 0.90 PARP1 (0.54) PARP1SMN1; SMN2MAPTPDE10AALDH1A1
SCHEMBL6798298 0.88 PARP1 (0.60) PARP1MAPTPDE10AALDH1A1KMT2A
SCHEMBL6791743 0.87 PARP1 (0.54) PARP1SMN1; SMN2MAPTPDE10AALDH1A1
SCHEMBL6802146 0.84 PARP1 (0.55) PARP1MAPTPDE10AKMT2APARP2
SCHEMBL6795593 0.84 PARP1 (0.64) PARP1SMN1; SMN2PDE10AALDH1A1KMT2A
SCHEMBL6795464 0.83 PARP1 (0.63) PARP1SMN1; SMN2PDE10AALDH1A1KMT2A
SCHEMBL6795780 0.81 PARP1 (0.61) PARP1SMN1; SMN2PDE10AALDH1A1KMT2A
Hydrochloric Acid SCHEMBL6789135 0.81 PDE10A (0.70) PARP1PDE10AALDH1A1KMT2APARP2
SCHEMBL4602305 0.77 ALDH1A1 (0.65) PARP1SMN1; SMN2MAPTPDE10AALDH1A1
SCHEMBL30176852 0.76 PARP1 (0.73) PARP1PDE10AALDH1A1KMT2APARP2

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-20040077667-A1 Quinazolinone derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-04-22 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-20040077667-A1 Quinazolinone derivatives PARP1, PARP9, PARP2 PARP1 1/4885SMN1; SMN2 3583/4885MAPT 3330/4885

“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.