SCHEMBL13610400

SCHEMBL13610400

N#Cc1ccc(Nc2ccccc2)c([N+](=O)[O-])c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.62
MAPT P10636 6/20 0.61
ALDH1A1 P00352 3/20 0.59
TDP1 Q9NUW8 2/20 0.59
MAPK1 P28482 2/20 0.59
HCAR3 P49019 1/20 0.59
CASP7 P55210 1/20 0.59
MERTK Q12866 1/20 0.59
POLB P06746 1/20 0.58
KDM4E B2RXH2 1/20 0.57
GAA P10253 1/20 0.57
WNK1 Q9H4A3 1/20 0.54
KAT2B Q92831 1/20 0.53
LMNA P02545 1/20 0.53
PKM P14618 1/20 0.53
LRRK2 Q5S007 2/20 0.53
VCAM1 P19320 1/20 0.53
CXCR2 P25025 1/20 0.49
KMT2A Q03164 4/20 0.48
MEN1 O00255 3/20 0.48

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
SCHEMBL31519032 1.00 L3MBTL1 (0.62) L3MBTL1MAPTALDH1A1TDP1MAPK1
SCHEMBL31519031 1.00 L3MBTL1 (0.62) L3MBTL1MAPTALDH1A1TDP1MAPK1
SCHEMBL11901853 0.88 TDP1 (0.59) L3MBTL1MAPTALDH1A1TDP1MAPK1
SCHEMBL11518576 0.86 MAPT (0.66) L3MBTL1MAPTALDH1A1TDP1MAPK1
SCHEMBL11514562 0.85 KAT2B (0.51) L3MBTL1MAPTALDH1A1TDP1MAPK1
SCHEMBL1762228 0.85 LRRK2 (0.51) L3MBTL1MAPTALDH1A1TDP1MAPK1
SCHEMBL2649258 0.85 LRRK2 (0.51) L3MBTL1MAPTALDH1A1TDP1MAPK1
SCHEMBL2653998 0.85 MEN1 (0.55) L3MBTL1MAPTALDH1A1TDP1MAPK1
SCHEMBL2276207 0.84 LRRK2 (0.55) L3MBTL1MAPTALDH1A1TDP1HCAR3
SCHEMBL27227167 0.82 MERTK (0.56) L3MBTL1MAPTALDH1A1TDP1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250136628-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2025-05-01 US disclosed
US-7622594-B2 Glucocortioid mimetics, methods of making them, pharmaceutical compositions, and uses thereof BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2009-11-24 US disclosed
US-20090140637-A1 NITROGEN-CONTAINING HETEROCYCLIC DERIVATIVE HAVING ELECTRON-ATTRACTING SUBSTITUENT AND ORGANIC ELECTROLUMINESCENCE ELEMENT USING THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2009-06-04 US disclosed
US-20070060633-A1 Glucocortioid mimetics, methods of making them, pharmaceutical compositions, and uses thereof BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2007-03-15 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 (2 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-20250136628-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES OCIAD1, OCIAD2, OPRD1 L3MBTL1 1865/4885MAPT 3226/4885ALDH1A1 1023/4885
US-20070060633-A1 Glucocortioid mimetics, methods of making them, pharmaceutical compositions, and uses thereof NR3C1, MC2R, NR3C2 L3MBTL1 3685/4885MAPT 322/4885ALDH1A1 2756/4885

“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.