SCHEMBL26164178

SCHEMBL26164178

O=[N+]([O-])c1cccc2c1[nH]c1c(-c3ccccc3)cccc1c1c(-c3ccccc3)cccc1c1ccccc21

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.56
FBP1 P09467 9/20 0.51
TDP1 Q9NUW8 2/20 0.50
ALDH1A1 P00352 2/20 0.50
MAPT P10636 2/20 0.46
NPC1 O15118 1/20 0.46
MAPK1 P28482 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
CDK4 P11802 2/20 0.44
CCND1 P24385 2/20 0.44
GUSB P08236 1/20 0.40
FEN1 P39748 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
SCHEMBL26164146 0.93 PARP1 (0.63) PARP1FBP1TDP1ALDH1A1MAPT
SCHEMBL26164175 0.91 PARP1 (0.52) PARP1FBP1TDP1ALDH1A1MAPT
SCHEMBL26164176 0.90 CDK4 (0.52) PARP1FBP1TDP1ALDH1A1MAPT
SCHEMBL26164171 0.88 PARP1 (0.55) PARP1FBP1TDP1ALDH1A1MAPT
SCHEMBL26167531 0.87 PARP1 (0.48) PARP1FBP1TDP1ALDH1A1MAPT
SCHEMBL26164184 0.86 PARP1 (0.58) PARP1FBP1TDP1ALDH1A1MAPT
SCHEMBL26167533 0.82 PARP1 (0.43) PARP1FBP1TDP1ALDH1A1MAPT
SCHEMBL21709358 0.78 CDK4 (0.56) PARP1ALDH1A1MAPK1CDK4CCND1
SCHEMBL26164179 0.76 CDK4 (0.49) PARP1TDP1ALDH1A1MAPTCDK4
SCHEMBL19893738 0.74 FEN1 (0.56) PARP1ALDH1A1MAPK1CDK4CCND1

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-20230167145-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2023-06-01 US disclosed
US-20230167145-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2023-06-01 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-20230167145-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES OCIAD1, OCIAD2, OSBP PARP1 2010/4885FBP1 3455/4885TDP1 1863/4885

“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.