SCHEMBL26164175

SCHEMBL26164175

Cc1cccc2c3ccccc3c3cccc([N+](=O)[O-])c3[nH]c3c(-c4ccccc4)cccc3c12

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 2/20 0.52
MAPT P10636 2/20 0.49
NPC1 O15118 1/20 0.49
MAPK1 P28482 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
FBP1 P09467 7/20 0.48
ALDH1A1 P00352 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
KDM4E B2RXH2 1/20 0.42
HSD17B10 Q99714 1/20 0.42
MGAM O43451 1/20 0.42
GAA P10253 1/20 0.42
SI P14410 1/20 0.42
MGAM2 Q2M2H8 1/20 0.42
CDK4 P11802 1/20 0.41
CCND1 P24385 1/20 0.41
TSHR P16473 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
KLK3 P07288 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
SCHEMBL26164178 0.91 PARP1 (0.56) PARP1MAPTNPC1MAPK1L3MBTL1
SCHEMBL26164146 0.90 PARP1 (0.63) PARP1MAPTNPC1MAPK1L3MBTL1
SCHEMBL26164176 0.87 CDK4 (0.52) PARP1MAPTNPC1MAPK1L3MBTL1
SCHEMBL26167531 0.86 PARP1 (0.48) PARP1MAPTNPC1MAPK1L3MBTL1
SCHEMBL26164184 0.83 PARP1 (0.58) PARP1MAPTNPC1MAPK1L3MBTL1
SCHEMBL26164169 0.81 PARP1 (0.58) PARP1MAPTNPC1MAPK1L3MBTL1
SCHEMBL26164171 0.80 PARP1 (0.55) PARP1MAPTNPC1MAPK1L3MBTL1
SCHEMBL26167533 0.79 PARP1 (0.43) PARP1MAPTNPC1MAPK1L3MBTL1
SCHEMBL21709358 0.75 CDK4 (0.56) PARP1MAPK1ALDH1A1KDM4EHSD17B10
SCHEMBL29539083 0.72 FEN1 (0.56) PARP1MAPK1ALDH1A1KDM4EHSD17B10

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-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 2010/4885MAPT 1004/4885NPC1 1538/4885

“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.