SCHEMBL5989580

SCHEMBL5989580

CC(=O)Nc1ccc2nc(C)cc(Cl)c2c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.56
MEN1 O00255 3/20 0.56
GNG2 P59768 2/20 0.56
GNB1 P62873 2/20 0.56
MMP1 P03956 1/20 0.56
MMP9 P14780 1/20 0.56
ALOX15 P16050 1/20 0.56
BLM P54132 1/20 0.56
LMNA P02545 2/20 0.55
NPC1 O15118 3/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
MAPT P10636 3/20 0.51
KDM4E B2RXH2 3/20 0.51
RAB9A P51151 2/20 0.51
PABPC1 P11940 1/20 0.51
POLB P06746 2/20 0.51
APAF1 O14727 1/20 0.51
USP2 O75604 1/20 0.51
MAPK1 P28482 1/20 0.51
UBE2N P61088 1/20 0.51

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
SCHEMBL3651398 0.84 MEN1 (0.57) KMT2AMEN1GNG2GNB1MMP1
SCHEMBL3645814 0.83 NPC1 (0.66) KMT2AMEN1MMP1MMP9NPC1
SCHEMBL7763069 0.82 GNG2 (0.81) KMT2AMEN1GNG2GNB1MMP1
SCHEMBL5989371 0.81 TERT (0.60) KMT2AMEN1GNG2GNB1MMP1
SCHEMBL13754217 0.80 LMNA (0.60) KMT2AMEN1GNG2GNB1MMP1
SCHEMBL3738216 0.80 DOT1L (0.57) KMT2AMEN1GNG2GNB1MMP1
SCHEMBL31672140 0.80 DOT1L (0.57) KMT2AMEN1GNG2GNB1MMP1
SCHEMBL6468321 0.78 EGFR (0.54) KMT2AMEN1NPC1MAPTKDM4E
SCHEMBL4748569 0.76 LMNA (0.58) KMT2ALMNANPC1SMN1; SMN2MAPT
SCHEMBL13697268 0.75 KMT2A (0.61) KMT2AMEN1GNG2GNB1MMP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060030565-A1 Amide derivatives and nociceptin antagonists JAPAN TOBACCO INC. 2006-02-09 US disclosed
US-6903094-B2 Amide derivatives and nociceptin antagonists JAPAN TABACCO, INC. (JP) 2005-06-07 US disclosed
US-20030055087-A1 Amide derivatives and nociceptin antagonists JAPAN TOBACCO INC. 2003-03-20 US disclosed
US-6410561-B1 ANALGESICS JAPAN TOBACCO INC. (JP) 2002-06-25 US disclosed
CN-1301154-A Amide derivatives and nociceptin antagonists JAPAN TOBACCO INC (JP) 2001-06-27 CN disclosed
EP-1072263-A1 AMIDE DERIVATIVES AND NOCICEPTIN ANTAGONISTS JAPAN TOBACCO INC. (JP) 2001-01-31 EP disclosed
US-4014877-A MICROBIOCIDES RIKER LABORATORIES, INC. (US) 1977-03-29 US disclosed
US-4001243-A ANTI-MICROBIAL RIKER LABORATORIES, INC. (US) 1977-01-04 US disclosed
US-3985882-A ADMISTERING RIKER LABORATORIES, INC. (US) 1976-10-12 US disclosed
US-3969463-A MICROBIOCIDE RIKER LABORATORIES, INC. (US) 1976-07-13 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-20030055087-A1 Amide derivatives and nociceptin antagonists OPRL1, OPRD1, OPRK1 KMT2A 1535/4885MEN1 4480/4885GNG2 715/4885
US-20060030565-A1 Amide derivatives and nociceptin antagonists OPRL1, OPRD1, OPRM1 KMT2A 1262/4885MEN1 4423/4885GNG2 710/4885

“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.