SCHEMBL13221849

SCHEMBL13221849

C=c1[nH]c(=O)c2ccc3c4c(ccc1c42)C(=O)NC3=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PARP1 P09874 4/20 0.40
▸ CASP7 P55210 2/20 0.40
▸ NPSR1 Q6W5P4 2/20 0.40
▸ CYP3A4 P08684 2/20 0.40
▸ TDP1 Q9NUW8 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ RGS12 O14924 1/20 0.40
▸ USP2 O75604 1/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ POLB P06746 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ THRB P10828 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ APEX1 P27695 1/20 0.40
▸ CASP1 P29466 1/20 0.40
▸ BRCA1 P38398 1/20 0.40
▸ MTOR P42345 1/20 0.40
▸ RECQL P46063 1/20 0.40
▸ BLM P54132 1/20 0.40
▸ GNAI1 P63096 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
SCHEMBL25868511 0.98 PARP1 (0.39) PARP1CASP7NPSR1CYP3A4TDP1
SCHEMBL15583044 0.98 PARP1 (0.39) PARP1CASP7NPSR1CYP3A4TDP1
SCHEMBL7601076 0.80 PARP1 (0.50) PARP1CASP7NPSR1CYP3A4TDP1
SCHEMBL30606639 0.80 PARP1 (0.50) PARP1CASP7NPSR1CYP3A4TDP1
SCHEMBL29541 0.80 PARP1 (0.50) PARP1CASP7NPSR1CYP3A4TDP1
SCHEMBL7598089 0.80 PARP1 (0.50) PARP1CASP7NPSR1CYP3A4TDP1
SCHEMBL18165030 0.76 PARP1 (0.43) PARP1CASP7NPSR1CYP3A4TDP1
SCHEMBL25872094 0.76 S100A4 (0.32) PARP1MEN1CYP1A2BLMPMP22
SCHEMBL7781183 0.75 PARP1 (0.35) PARP1CASP7NPSR1CYP3A4TDP1
SCHEMBL278438 0.74 PARP1 (0.59) PARP1CASP7NPSR1CYP3A4TDP1

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-8404705-B2 Naphthalene amidine imides BASF SE (DE) 2013-03-26 — — US disclosed
US-20100202984-A1 Naphthalene amidine imides BASF SE (DE) 2010-08-12 — — 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-20100202984-A1 Naphthalene amidine imides NES, TXN2, NAT1 PARP1 1069/4885CASP7 2081/4885NPSR1 1009/4885

“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.

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