SCHEMBL4121951

SCHEMBL4121951

CCc1ccc(NC(=O)Nc2ccccc2[N+](=O)[O-])cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 4/20 0.67
NPSR1 Q6W5P4 1/20 0.61
LMNA P02545 2/20 0.60
CXCR1 P25024 1/20 0.58
CXCR2 P25025 1/20 0.58
KMT2A Q03164 3/20 0.57
TP53 P04637 1/20 0.57
ABCB1 P08183 2/20 0.57
ALDH1A1 P00352 3/20 0.56
GAA P10253 3/20 0.56
MEN1 O00255 2/20 0.56
MAPT P10636 2/20 0.56
ALPG P10696 1/20 0.56
TDP1 Q9NUW8 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
POLB P06746 2/20 0.56
NPC1 O15118 2/20 0.54
MAPK1 P28482 1/20 0.54
RAB9A P51151 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54

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
SCHEMBL5852169 0.85 LMNA (0.68) ABCG2LMNACXCR1CXCR2KMT2A
SCHEMBL4388940 0.84 CXCR2 (0.78) LMNACXCR1CXCR2KMT2ATP53
SCHEMBL11332310 0.82 KMT2A (0.73) NPSR1LMNACXCR1CXCR2KMT2A
SCHEMBL1311622 0.82 CXCR1 (0.62) ABCG2LMNACXCR1CXCR2KMT2A
SCHEMBL15082040 0.81 L3MBTL1 (0.68) ABCG2NPSR1LMNAKMT2AALDH1A1
SCHEMBL4124277 0.80 MEN1 (0.74) ABCG2NPSR1LMNAKMT2AALDH1A1
SCHEMBL11047722 0.80 MEN1 (0.74) ABCG2NPSR1LMNAKMT2AALDH1A1
SCHEMBL14514336 0.79 NPC1 (0.64) ABCG2LMNACXCR1CXCR2KMT2A
SCHEMBL14561170 0.79 RAB9A (0.67) KMT2ATP53GAAMEN1MAPT
SCHEMBL15306504 0.78 CXCR2 (0.65) ABCG2LMNACXCR1CXCR2KMT2A

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-20090239841-A1 Diaryl Ureas as CB1 Antagonists NEUROGEN CORPORATION 2009-09-24 US disclosed
US-20090239841-A1 Diaryl Ureas as CB1 Antagonists NEUROGEN CORPORATION 2009-09-24 US disclosed
EP-1804785-A2 DIARYL UREAS AS CB1 ANTAGONISTS NEUROGEN CORPORATION (US) 2007-07-11 EP disclosed
WO-2006049941-A2 DIARYL UREAS AS CB1 ANTAGONISTS NEUROGEN CORPORATION (US) 2006-05-11 WO 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-20090239841-A1 Diaryl Ureas as CB1 Antagonists CNR1, CNR2, OPRL1 ABCG2 2911/4885NPSR1 66/4885LMNA 4283/4885

“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.