SCHEMBL6989004

SCHEMBL6989004

NC(=O)C(=O)Nc1cccnc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.71
NPC1 O15118 2/20 0.71
PKM P14618 1/20 0.71
LMNA P02545 2/20 0.59
HIF1A Q16665 1/20 0.59
NAMPT P43490 3/20 0.57
TP53 P04637 1/20 0.56
MEN1 O00255 4/20 0.54
KMT2A Q03164 4/20 0.54
ALDH1A1 P00352 3/20 0.54
KDM4E B2RXH2 2/20 0.54
PRKCI P41743 1/20 0.54
CYP11B1 P15538 3/20 0.53
CYP11B2 P19099 3/20 0.53
CDK2 P24941 1/20 0.53
FLT4 P35916 1/20 0.53
HPGD P15428 1/20 0.53
MAPT P10636 1/20 0.53
ALOX15 P16050 1/20 0.53
HTT P42858 1/20 0.53

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
Hydrochloric Acid SCHEMBL28051146 0.98 RAB9A (0.69) RAB9ANPC1PKMLMNAHIF1A
SCHEMBL30504811 0.88 RAB9A (0.89) RAB9ANPC1PKMLMNAHIF1A
SCHEMBL162008 0.85 RAB9A (0.65) RAB9ANPC1PKMLMNAHIF1A
SCHEMBL29655934 0.85 RAB9A (0.65) RAB9ANPC1PKMLMNAHIF1A
Hydrochloric Acid SCHEMBL27677130 0.83 RAB9A (0.62) RAB9ANPC1PKMLMNAHIF1A
SCHEMBL6630167 0.83 RAB9A (0.79) RAB9ANPC1PKMLMNAHIF1A
SCHEMBL9262080 0.81 RAB9A (0.71) RAB9ANPC1PKMLMNAHIF1A
SCHEMBL9637653 0.80 MEN1 (0.77) RAB9ANPC1PKMLMNAHIF1A
SCHEMBL30051982 0.80 MEN1 (0.77) RAB9ANPC1PKMLMNAHIF1A
Boric Acid SCHEMBL29121086 0.80 RAB9A (0.59) RAB9ANPC1PKMLMNAHIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116332840-A Bisamide pyridine quaternary ammonium salt water-based paint anti-corrosion inhibitor and preparation method thereof 山西大学 2023-06-27 CN claimed
CN-116332840-A Bisamide pyridine quaternary ammonium salt water-based paint anti-corrosion inhibitor and preparation method thereof 山西大学 2023-06-27 CN disclosed
CN-116332840-A Bisamide pyridine quaternary ammonium salt water-based paint anti-corrosion inhibitor and preparation method thereof 山西大学 2023-06-27 CN disclosed
CN-1826333-B Diamine derivatives DAIICHI SANKYO CO LTD 2012-12-26 CN disclosed
EP-1358160-A1 AMINAL DIONES AS POTASSIUM CHANNEL OPENERS Abbott Laboratories (US) 2003-11-05 EP disclosed
US-6495576-B2 N-(1-((3,4-DIOXO-2-(3-PYRIDINYLAMINO)-1-CYCLOBUTEN-1-YL)AMINO) -2,2-DIMETHYLPROPYL)-4-METHYLBENZAMIDE FOR EXAMPLE; TREATING BLADDER OVERACTIVITY, BENIGN PROSTATIC HYPERPLASIA, PREMATURE LABOR, AND SEXUAL DISORDERS ABBOTT LABORATORIES 2002-12-17 US disclosed
US-20020165264-A1 Aminal diones as potassium channel openers ABBOTT LABORATORIES 2002-11-07 US disclosed
US-20020147230-A1 Aminal Diones as potassium channel openers ABBOTT LABORATORIES 2002-10-10 US disclosed
WO-2002062761-A1 AMINAL DIONES AS POTASSIUM CHANNEL OPENERS ABBOTT LABORATORIES (US) 2002-08-15 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 (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-20020147230-A1 Aminal Diones as potassium channel openers KCNJ2, KCNJ11, KCNH1 RAB9A 3503/4885NPC1 735/4885PKM 633/4885
US-20020165264-A1 Aminal diones as potassium channel openers KCNJ2, KCNJ11, KCNH1 RAB9A 3503/4885NPC1 735/4885PKM 633/4885

“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.